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2-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-4-thione
SpectraBase Compound ID EfvkUKqoyOL
InChI InChI=1S/C15H13NS2/c17-15-10-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-9,14H,10H2,(H,16,17)
InChIKey FQEWVXXAJZVQAC-UHFFFAOYSA-N
Mol Weight 271.4 g/mol
Molecular Formula C15H13NS2
Exact Mass 271.048942 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ExjDKqgVMNk
Name 2-Phenyl-2,3-dihydro-1,5-benzothiazepin-4(5H)-thione
Alternate Name(s) 2-Phenyl-2,3-dihydro-1,5-benzothiazepine-4(5H)-thione 2-Phenyl-3,5-dihydro-2H-1,5-benzothiazepine-4-thione
CAS Registry Number 29476-14-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H13NS2
InChI InChI=1S/C15H13NS2/c17-15-10-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-9,14H,10H2,(H,16,17)
InChIKey FQEWVXXAJZVQAC-UHFFFAOYSA-N
Molecular Weight 271.396 g/mol
SMILES N1C(CC(Sc2c1cccc2)c1ccccc1)=S
SPLASH splash10-00kk-1950000000-0c4b59589e471f4ca3f3
Source of Spectrum O-29-303-0
Wiley ID 1275280