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Isothiazole, trimethyl-
SpectraBase Compound ID HnExVPRaWWd
InChI InChI=1S/C6H9NS/c1-4-5(2)7-8-6(4)3/h1-3H3
InChIKey GGRRWFKQGMXXQS-UHFFFAOYSA-N
Mol Weight 127.2 g/mol
Molecular Formula C6H9NS
Exact Mass 127.04557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EM3NsuRNkaC
Name Isothiazole, trimethyl-
CAS Registry Number 39228-36-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NS
InChI InChI=1S/C6H9NS/c1-4-5(2)7-8-6(4)3/h1-3H3
InChIKey GGRRWFKQGMXXQS-UHFFFAOYSA-N
Molecular Weight 127.205 g/mol
SMILES Cc1c(C)nsc1C
SPLASH splash10-004i-6900000000-9b249107c58ead5fa553
Source of Spectrum AC-72-3833-9
Synonyms 3,4,5-trimethyl-1,2-thiazole
Wiley ID 1130677