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Propenone, 3-(5-chloro-2-benzothiazolylthio)-1-(4-methylphenyl)-
SpectraBase Compound ID FZyUyqx9nY1
InChI InChI=1S/C17H12ClNOS2/c1-11-2-4-12(5-3-11)15(20)8-9-21-17-19-14-10-13(18)6-7-16(14)22-17/h2-10H,1H3/b9-8+
InChIKey OYRWPXIESYDDHE-CMDGGOBGSA-N
Mol Weight 345.86 g/mol
Molecular Formula C17H12ClNOS2
Exact Mass 345.004884 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4IZOuCGPZ77
Name (2E)-3-[(5-Chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylphenyl)-2-propen-1-one
CAS Registry Number 277325-87-8
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12ClNOS2
InChI InChI=1S/C17H12ClNOS2/c1-11-2-4-12(5-3-11)15(20)8-9-21-17-19-14-10-13(18)6-7-16(14)22-17/h2-10H,1H3/b9-8+
InChIKey OYRWPXIESYDDHE-CMDGGOBGSA-N
Molecular Weight 345.862 g/mol
SMILES Cc1ccc(C(\C=C\Sc2nc3c(ccc(c3)Cl)s2)=O)cc1
SPLASH splash10-004i-9770000000-39ebfb6deab9ee52658b
Source of Spectrum AD-0-2532-0
Synonyms (E)-3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylphenyl)prop-2-en-1-one (E)-3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(4-methylphenyl)prop-2-en-1-one (E)-3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-1-(p-tolyl)prop-2-en-1-one (E)-3-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(4-methylphenyl)-2-propen-1-one (E)-3-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-(p-tolyl)prop-2-en-1-one Propenone, 3-(5-chloro-2-benzothiazolylthio)-1-(4-methylphenyl)-
Wiley ID 1431646