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4-[2-(4-Chlorophenyl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
SpectraBase Compound ID BfCAErvGcrT
InChI InChI=1S/C16H12ClNO2S/c17-12-7-5-11(6-8-12)14(19)9-18-13-3-1-2-4-15(13)21-10-16(18)20/h1-8H,9-10H2
InChIKey VKFNJTHOXSIOQH-UHFFFAOYSA-N
Mol Weight 317.79 g/mol
Molecular Formula C16H12ClNO2S
Exact Mass 317.027728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5lSoBpVUtPK
Name 4-[2-(4-Chlorophenyl)-2-oxoethyl]-2H-1,4-benzothiazin-3(4H)-one
CAS Registry Number 120622-15-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12ClNO2S
InChI InChI=1S/C16H12ClNO2S/c17-12-7-5-11(6-8-12)14(19)9-18-13-3-1-2-4-15(13)21-10-16(18)20/h1-8H,9-10H2
InChIKey VKFNJTHOXSIOQH-UHFFFAOYSA-N
Molecular Weight 317.790 g/mol
SMILES c1ccc2c(c1)N(CC(c1ccc(cc1)Cl)=O)C(CS2)=O
SPLASH splash10-0uxr-0902000000-5c07ef87e29f6ce7bbb0
Source of Spectrum O-24-512-16
Synonyms 4-(4-Chlorobenzoylmethyl)-2H-1,4-benzthiazin-3-one 4-[2-(4-chlorophenyl)-2-keto-ethyl]-1,4-benzothiazin-3-one 4-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]-1,4-benzothiazin-3-one 4-[2-(4-chlorophenyl)-2-oxo-ethyl]-1,4-benzothiazin-3-one
Wiley ID 1317586