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2,4-Diphenyl-2,3-dihydro-1,5-benzothiazepine
SpectraBase Compound ID 6CT9NptNXWS
InChI InChI=1S/C21H17NS/c1-3-9-16(10-4-1)19-15-21(17-11-5-2-6-12-17)23-20-14-8-7-13-18(20)22-19/h1-14,21H,15H2
InChIKey MPAHDNFCERDKSX-UHFFFAOYSA-N
Mol Weight 315.43 g/mol
Molecular Formula C21H17NS
Exact Mass 315.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KBVNVl7IslP
Name 2,4-Diphenyl-2,3-dihydro-1,5-benzothiazepine
Alternate Name(s) 1,5-Benzothiazepine, 2,3-dihydro-2,4-diphenyl-
CAS Registry Number 40358-31-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NS
InChI InChI=1S/C21H17NS/c1-3-9-16(10-4-1)19-15-21(17-11-5-2-6-12-17)23-20-14-8-7-13-18(20)22-19/h1-14,21H,15H2
InChIKey MPAHDNFCERDKSX-UHFFFAOYSA-N
Molecular Weight 315.434 g/mol
SMILES c1ccc(C2CC(=Nc3c(S2)cccc3)c2ccccc2)cc1
SPLASH splash10-03di-0290000000-ef04c5453e1863c6ca2b
Source of Spectrum O-15-644-1
Wiley ID 1316207