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N-Isopropylisothiazol-3(2H)-one
SpectraBase Compound ID L3TOODdxxeL
InChI InChI=1S/C6H9NOS/c1-5(2)7-6(8)3-4-9-7/h3-5H,1-2H3
InChIKey NCFYEUINUSWAMO-UHFFFAOYSA-N
Mol Weight 143.2 g/mol
Molecular Formula C6H9NOS
Exact Mass 143.040485 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QgzNFZBKq2
Name N-Isopropylisothiazol-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NOS
InChI InChI=1S/C6H9NOS/c1-5(2)7-6(8)3-4-9-7/h3-5H,1-2H3
InChIKey NCFYEUINUSWAMO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100174
Molecular Weight 143.204 g/mol
SMILES C1(N(SC=C1)C(C)C)=O
SPLASH splash10-0udi-2900000000-7da1402e4b9659651656
Source of Spectrum QA-48-1187-5b
Synonyms 2-isopropylisothiazol-3(2H)-one
Wiley ID 1795528