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(2E)-1-(4-Bromophenyl)-3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-propen-1-one
SpectraBase Compound ID 8RFzKUriQiv
InChI InChI=1S/C16H9BrClNOS2/c17-11-3-1-10(2-4-11)14(20)7-8-21-16-19-13-9-12(18)5-6-15(13)22-16/h1-9H/b8-7+
InChIKey YJRRMYRVZIFNMT-BQYQJAHWSA-N
Mol Weight 410.73 g/mol
Molecular Formula C16H9BrClNOS2
Exact Mass 408.899747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EKCWHFm6D6X
Name (2E)-1-(4-Bromophenyl)-3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-2-propen-1-one
Alternate Name(s) (E)-1-(4-bromophenyl)-3-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]prop-2-en-1-one (E)-1-(4-bromophenyl)-3-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]prop-2-en-1-one (E)-1-(4-bromophenyl)-3-[(5-chloro-1,3-benzothiazol-2-yl)thio]-2-propen-1-one (E)-1-(4-bromophenyl)-3-[(5-chloro-1,3-benzothiazol-2-yl)thio]prop-2-en-1-one Propenone, 1-(4-bromophenyl)-3-(5-chloro-2-benzothiazolylthio)-
CAS Registry Number 277325-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9BrClNOS2
InChI InChI=1S/C16H9BrClNOS2/c17-11-3-1-10(2-4-11)14(20)7-8-21-16-19-13-9-12(18)5-6-15(13)22-16/h1-9H/b8-7+
InChIKey YJRRMYRVZIFNMT-BQYQJAHWSA-N
Molecular Weight 410.731 g/mol
SMILES c1cc(C(\C=C\Sc2nc3c(ccc(c3)Cl)s2)=O)ccc1Br
SPLASH splash10-004i-3590000000-48c1e42ef568118f9e6f
Source of Spectrum AD-0-2532-0
Wiley ID 1427163