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2-(4-Chlorophenyl)-4-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine

View entire compound with spectra: 1 MS (GC)

2-(4-Chlorophenyl)-4-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine
SpectraBase Compound ID 9gIuz8OkiOo
InChI InChI=1S/C21H18ClNS/c22-17-12-10-16(11-13-17)21-14-19(15-6-2-1-3-7-15)23-18-8-4-5-9-20(18)24-21/h1-13,19,21,23H,14H2
InChIKey RWIBJUCVIPUGMO-UHFFFAOYSA-N
Mol Weight 351.9 g/mol
Molecular Formula C21H18ClNS
Exact Mass 351.084848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LYbYWJ7wm6r
Name 2-(4-Chlorophenyl)-4-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine
Alternate Name(s) 2-(4-Chlorophenyl)-4-phenyl-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClNS
InChI InChI=1S/C21H18ClNS/c22-17-12-10-16(11-13-17)21-14-19(15-6-2-1-3-7-15)23-18-8-4-5-9-20(18)24-21/h1-13,19,21,23H,14H2
InChIKey RWIBJUCVIPUGMO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.1905
Molecular Weight 351.895 g/mol
SMILES N1C(CC(Sc2c1cccc2)c1ccc(cc1)Cl)c1ccccc1
SPLASH splash10-0j70-0698000000-a8f9ec082a14e1328516
Source of Spectrum RCM-19-1204-13
Wiley ID 1820283