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N-tert-Butylisothiazol-3(2H)-one
SpectraBase Compound ID Hsu348UrDHb
InChI InChI=1S/C7H11NOS/c1-7(2,3)8-6(9)4-5-10-8/h4-5H,1-3H3
InChIKey ODQNPFWWAYSDOI-UHFFFAOYSA-N
Mol Weight 157.23 g/mol
Molecular Formula C7H11NOS
Exact Mass 157.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZ0l83ccYg0
Name N-tert-Butylisothiazol-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NOS
InChI InChI=1S/C7H11NOS/c1-7(2,3)8-6(9)4-5-10-8/h4-5H,1-3H3
InChIKey ODQNPFWWAYSDOI-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100174
Molecular Weight 157.231 g/mol
SMILES C1(N(SC=C1)C(C)(C)C)=O
SPLASH splash10-0zfr-2900000000-35eb8b06d412b853b813
Source of Spectrum QA-48-1187-5c
Synonyms 2-(tert-butyl)isothiazol-3(2H)-one
Wiley ID 1795529