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1,5-Benzothiazepin-4(5H)-one, 2-phenyl-
SpectraBase Compound ID B6MmwtylCyT
InChI InChI=1S/C15H11NOS/c17-15-10-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-10H,(H,16,17)
InChIKey DWHHMNUHVCUPMD-UHFFFAOYSA-N
Mol Weight 253.32 g/mol
Molecular Formula C15H11NOS
Exact Mass 253.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lmy6CszL7JK
Name 1,5-Benzothiazepin-4(5H)-one, 2-phenyl-
CAS Registry Number 5667-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11NOS
InChI InChI=1S/C15H11NOS/c17-15-10-14(11-6-2-1-3-7-11)18-13-9-5-4-8-12(13)16-15/h1-10H,(H,16,17)
InChIKey DWHHMNUHVCUPMD-UHFFFAOYSA-N
Molecular Weight 253.319 g/mol
SMILES N1c2c(SC(=CC1=O)c1ccccc1)cccc2
SPLASH splash10-0096-5590000000-e2222f9f1c46ff23625a
Source of Spectrum K-119-3116-5
Synonyms 2-Phenyl-1,5-benzothiazepin-4(5H)-one 2-Phenyl-5H-1,5-benzothiazepin-4-one BRN 0747523 NSC 167704
Wiley ID 1256812