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2,3-Dihydro-2-(4-nitrophenyl)-4-phenyl-1,5-benzothiazepine
SpectraBase Compound ID 6owb7wWbHX0
InChI InChI=1S/C21H16N2O2S/c24-23(25)17-12-10-16(11-13-17)21-14-19(15-6-2-1-3-7-15)22-18-8-4-5-9-20(18)26-21/h1-13,21H,14H2
InChIKey HCOVSUWQMKZWAW-UHFFFAOYSA-N
Mol Weight 360.43 g/mol
Molecular Formula C21H16N2O2S
Exact Mass 360.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9oMzp800rC9
Name 2,3-Dihydro-2-(4-nitrophenyl)-4-phenyl-1,5-benzothiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O2S
InChI InChI=1S/C21H16N2O2S/c24-23(25)17-12-10-16(11-13-17)21-14-19(15-6-2-1-3-7-15)22-18-8-4-5-9-20(18)26-21/h1-13,21H,14H2
InChIKey HCOVSUWQMKZWAW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/cbdv.200590029
Molecular Weight 360.431 g/mol
SMILES C1(Sc2c(N=C(C1)c1ccccc1)cccc2)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-03fr-6392000000-29d6a90da7b2a5931f80
Source of Spectrum CBD-2-493-35
Synonyms 2-(4-nitrophenyl)-4-phenyl-2,3-dihydrobenzo[b][1,4]thiazepine
Wiley ID 1790188