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N-Phenylisothiazol-3(2H)-one
SpectraBase Compound ID Jf7T2PyJXFl
InChI InChI=1S/C9H7NOS/c11-9-6-7-12-10(9)8-4-2-1-3-5-8/h1-7H
InChIKey VFUQPOSQUAVDEZ-UHFFFAOYSA-N
Mol Weight 177.22 g/mol
Molecular Formula C9H7NOS
Exact Mass 177.024835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CAe13fHof8S
Name N-Phenylisothiazol-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NOS
InChI InChI=1S/C9H7NOS/c11-9-6-7-12-10(9)8-4-2-1-3-5-8/h1-7H
InChIKey VFUQPOSQUAVDEZ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100174
Molecular Weight 177.221 g/mol
SMILES C1(N(SC=C1)c1ccccc1)=O
SPLASH splash10-004i-1900000000-5f1f2c2075e1e4c3c76a
Source of Spectrum QA-48-1187-5d
Synonyms 2-Phenylisothiazol-3(2H)-one
Wiley ID 1795530