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(S) 2-(4-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
SpectraBase Compound ID 7HVl9pVCxOo
InChI InChI=1S/C21H16ClNS/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/h1-13,21H,14H2/t21-/m0/s1
InChIKey PNVWIHLFACUKDT-NRFANRHFSA-N
Mol Weight 349.88 g/mol
Molecular Formula C21H16ClNS
Exact Mass 349.069198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 44O3U21Kls
Name (S) 2-(4-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine
Alternate Name(s) 2-(4-Chlorophenyl)-4-phenyl-2,3-dihydro-1,5-benzothiazepine (S)-2-(4-chlorophenyl)-4-phenyl-2,3-dihydrobenzo[b][1,4]thiazepine
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Formula C21H16ClNS
InChI InChI=1S/C21H16ClNS/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/h1-13,21H,14H2/t21-/m0/s1
InChIKey PNVWIHLFACUKDT-NRFANRHFSA-N
Molecular Weight 349.879 g/mol
SMILES C1(=Nc2c(S[C@@](C1)(c1ccc(cc1)Cl)[H])cccc2)c1ccccc1
SPLASH splash10-0bt9-3960000000-cab2b15c8a079e5ad770
Source of Spectrum Y-51-145-2
Wiley ID 1741213