2-methyl-4'-(methylthio)-2-morpholinopropiophenonelatest revision: 1/16/2018...
TRANSCRIPT
Page 1 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/16/2018
2-Methyl-4'-(methylthio)-2-morpholinopropiophenoneThe Drug Enforcement Administration's Special Testing and Research Laboratory
generated this monograph using structurally confirmed reference material.
1. GENERAL INFORMATION
IUPAC Name:
CAS#:
Synonyms:
Source:
Appearance:
UVmax(nm):
2-Methyl-1-(4-(methylthio)phenyl)-2-morpholinopropiopan-1-one
71868-10-5
MMMP, MTMP, Caccure 907
DEA Reference Material Collection
White powder
Not Determined
2. CHEMICAL AND PHYSICAL DATA
2.1 CHEMICAL DATA
Form Chemical Formula Molecular Weight Melting Point (oC)
Base C15H21NO2S 279.40 Not Determined
SCH3
O
CH3
N
O
CH3
Page 2 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/16/2018
2-Methyl-4'-(methylthio)-2-morpholinopropiophenoneThe Drug Enforcement Administration's Special Testing and Research Laboratory
generated this monograph using structurally confirmed reference material.
3. QUALITATIVE DATA
3.1 NUCLEAR MAGNETIC RESONANCE
Sample Preparation: Dilute analyte to ~23 mg/mL in CDCl3 containing TMS for 0 ppm reference and 1,4-BTMSB as quantitative internal standard.
Instrument: 400 MHz NMR spectrometerParameters: Spectral width: at least containing -3.0 ppm through 13.0 ppm
Pulse angle: 90o
Delay between pulses: 45 seconds1HNMR: 2-Methyl-4'-(methylthio)-2-morpholinopropiophenone; Lot X4MPL-KH; 400MHz
8 7 6 5 4 3 2 1 0
0
1
2
3
4
5
6
7
8
9
10
63422
CHCl3TMS
BTMSB
7.275 7.250 7.225
2
CHCl3
8.575 8.525
2
3.675
4
2.575 2.525
34
1.350 1.300
6
4
Page 3 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/16/2018
2-Methyl-4'-(methylthio)-2-morpholinopropiophenoneThe Drug Enforcement Administration's Special Testing and Research Laboratory
generated this monograph using structurally confirmed reference material.
3.2 GAS CHROMATOGRAPHY/MASS SPECTROMETRY
Sample Preparation: Dilute analyte ~4 mg/mL in chloroform base extracted with sodium carbonate.
Instrument: Agilent gas chromatograph operated in split mode with MS detectorColumn: HP-5 MS (or equivalent); 30m x 0.25 mm x 0.25mCarrier Gas: Helium at 1.5 mL/minTemperatures: Injector: 280oC
MSD transfer line: 280oCMS Source: 230oCMS Quad: 150oCOven program:
1) 100oC initial temperature for 1.0 min2) Ramp to 280oC at 12 oC/min3) Hold final temperature for 9.0 min
Injection Parameters: Split Ratio = 25:1, 1 L injectedMS Parameters: Mass scan range: 30-550 amu
Threshold: 100Tune file: stune.uAcquisition mode: scan
Retention Time: 13.571 minEI Mass Spectrum: 2-Methyl-4'-(methylthio)-2-morpholinopropiophenone, Lot X4MPL-KH
m/z280260240220200180160140120100806040
[x 1
06 ]In
tens
ity
2
428
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
028
0
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
979797 9797979797 9797979797 9797979797 97979797919191 9191919191 9191919191 9191919191 91919191848484 8484848484 8484848484 8484848484 84848484696969 6969696969 6969696969 6969696969 69696969565656 5656565656 5656565656 5656565656 56565656424242 4242424242 4242424242 4242424242 42424242EI+
m/z280260240220200180160140120100806040
[x 1
04 ]In
tens
ity
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
280
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
264
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
250
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
236
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
217
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
205
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
192
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
177
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
165
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
151
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
128
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
108
979797 9797979797 9797979797 9797979797 97979797919191 9191919191 9191919191 9191919191 91919191848484 8484848484 8484848484 8484848484 84848484696969 6969696969 6969696969 6969696969 69696969565656 5656565656 5656565656 5656565656 56565656424242 4242424242 4242424242 4242424242 42424242
EI+
Page 4 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/16/2018
2-Methyl-4'-(methylthio)-2-morpholinopropiophenoneThe Drug Enforcement Administration's Special Testing and Research Laboratory
generated this monograph using structurally confirmed reference material.
3.3 INFRARED SPECTROSCOPY (FTIR)
Instrument:Scan Parameters:
FTIR with diamond ATR attachment (1 bounce)Number of scans: 32Number of background scans: 32Resolution: 4 cm-1
Sample gain: 1Aperture: 150
FTIR ATR (Diamond 1 Bounce): 2-Methyl-4'-(methylthio)-2-morpholinopropiophenone, Lot# X4MPL-KH
Wavenumber (cm-1)3500 3000 2500 2000 1500
%Tr
ansm
ittan
ce
30
40
50
60
70 2853285328532853285328532853285328532853285328532853285328532853285328532853285328532853
1665166516651665166516651665166516651665166516651665166516651665166516651665166516651665
1584158415841584158415841584158415841584158415841584158415841584158415841584158415841584
1448144814481448144814481448144814481448144814481448144814481448144814481448144814481448 1363
136313631363136313631363136313631363136313631363136313631363136313631363136313631363
1258125812581258125812581258125812581258125812581258125812581258125812581258125812581258
1191119111911191119111911191119111911191119111911191119111911191119111911191119111911191
1153115311531153115311531153115311531153115311531153115311531153115311531153115311531153
11121112111211121112111211121112111211121112111211121112111211121112111211121112111211121091109110911091109110911091109110911091109110911091109110911091109110911091109110911091
1002100210021002100210021002100210021002100210021002100210021002100210021002100210021002
977977977977977977977977977977977977977977977977977977977977977977
877877877877877877877877877877877877877877877877877877877877877877
829829829829829829829829829829829829829829829829829829829829829829 753
753753753753753753753753753753753753753753753753753753753753753
692692692692692692692692692692692692692692692692692692692692692692669669669669669669669669669669669669669669669669669669669669669669
563563563563563563563563563563563563563563563563563563563563563563 492
492492492492492492492492492492492492492492492492492492492492492
405405405405405405405405405405405405405405405405405405405405405405
Wavenumber (cm-1)1700 1600 1500 1400 1300 1200 1100 1000 900 800 700
%Tr
ansm
ittan
ce
30
40
50
60
70
1665166516651665166516651665166516651665166516651665166516651665166516651665166516651665
1584158415841584158415841584158415841584158415841584158415841584158415841584158415841584
1448144814481448144814481448144814481448144814481448144814481448144814481448144814481448 1363
136313631363136313631363136313631363136313631363136313631363136313631363136313631363
1289128912891289128912891289128912891289128912891289128912891289128912891289128912891289
1258125812581258125812581258125812581258125812581258125812581258125812581258125812581258
1191119111911191119111911191119111911191119111911191119111911191119111911191119111911191
1153115311531153115311531153115311531153115311531153115311531153115311531153115311531153
11121112111211121112111211121112111211121112111211121112111211121112111211121112111211121091109110911091109110911091109110911091109110911091109110911091109110911091109110911091
1002100210021002100210021002100210021002100210021002100210021002100210021002100210021002
977977977977977977977977977977977977977977977977977977977977977977
923923923923923923923923923923923923923923923923923923923923923923
877877877877877877877877877877877877877877877877877877877877877877
852852852852852852852852852852852852852852852852852852852852852852
829829829829829829829829829829829829829829829829829829829829829829 753
753753753753753753753753753753753753753753753753753753753753753
692692692692692692692692692692692692692692692692692692692692692692669669669669669669669669669669669669669669669669669669669669669669
563563563563563563563563563563563563563563563563563563563563563563 492
492492492492492492492492492492492492492492492492492492492492492
405405405405405405405405405405405405405405405405405405405405405405
Page 5 of 5SWGDRUG.org/monographs.htmLatest Revision: 1/16/2018
2-Methyl-4'-(methylthio)-2-morpholinopropiophenoneThe Drug Enforcement Administration's Special Testing and Research Laboratory
generated this monograph using structurally confirmed reference material.
http://forendex.safs1966.org/index.php/detail/index/1131
https://en.wikipedia.org/wiki/Alpha-Pyrrolidinopropiophenone
4. ADDITIONAL RESOURCES
No Literature available as of 11/1/2017