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1,5-Benzothiazepine, 2,3,4,5-tetrahydro-2-methyl-4-phenyl-
SpectraBase Compound ID WQ1H9LwlbR
InChI InChI=1S/C16H17NS/c1-12-11-15(13-7-3-2-4-8-13)17-14-9-5-6-10-16(14)18-12/h2-10,12,15,17H,11H2,1H3
InChIKey VFVHAAAQHXTXQL-UHFFFAOYSA-N
Mol Weight 255.38 g/mol
Molecular Formula C16H17NS
Exact Mass 255.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6wizgOsFLwT
Name 1,5-Benzothiazepine, 2,3,4,5-tetrahydro-2-methyl-4-phenyl-
CAS Registry Number 13338-10-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NS
InChI InChI=1S/C16H17NS/c1-12-11-15(13-7-3-2-4-8-13)17-14-9-5-6-10-16(14)18-12/h2-10,12,15,17H,11H2,1H3
InChIKey VFVHAAAQHXTXQL-UHFFFAOYSA-N
Molecular Weight 255.379 g/mol
SMILES N1C(CC(Sc2ccccc12)C)c1ccccc1
SPLASH splash10-08g0-3980000000-bb06f0a66bfe3b0743b4
Source of Spectrum W6-1989-24796-1
Synonyms 2-Methyl-4-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine
Wiley ID 138912