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1,3-DIHYDRO-1,4-DIMETHYL-2-OXO-5-PHENYL-2H-1,4-BENZODIAZEPINIUM METHYL SULFATE

View entire compound with spectra: 1 FTIR

1,3-DIHYDRO-1,4-DIMETHYL-2-OXO-5-PHENYL-2H-1,4-BENZODIAZEPINIUM METHYL SULFATE
SpectraBase Compound ID LXK4yjHFAzx
InChI InChI=1S/C17H17N2O.CH4O4S/c1-18-12-16(20)19(2)15-11-7-6-10-14(15)17(18)13-8-4-3-5-9-13;1-5-6(2,3)4/h3-11H,12H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey SCKCWIPPYKFDHD-UHFFFAOYSA-M
Mol Weight 376.43 g/mol
Molecular Formula C18H20N2O5S
Exact Mass 376.109293 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID KalOJj80svp
Name 1,3-DIHYDRO-1,4-DIMETHYL-2-OXO-5-PHENYL-2H-1,4-BENZODIAZEPINIUM METHYL SULFATE
Source of Sample J. V. Earley, Hoffmann-La Roche, Inc., Nutley, New Jersey
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O5S
InChI InChI=1S/C17H17N2O.CH4O4S/c1-18-12-16(20)19(2)15-11-7-6-10-14(15)17(18)13-8-4-3-5-9-13;1-5-6(2,3)4/h3-11H,12H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKey SCKCWIPPYKFDHD-UHFFFAOYSA-M
Literature Reference JOCE 34, 649(1969)
Melting Point 176-180C
Molecular Weight 376.427002
Synonyms BENZODIAZEPINIUM METHYL SULFATE, 2H-1,4-, 1,3-DIHYDRO-1,4-DIMETHYL-2- OXO-5-PHENYL-,
Technique KBr WAFER