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N-propylisothiazole-3(2H)-one

View entire compound with spectra: 1 MS (GC)

N-propylisothiazole-3(2H)-one
SpectraBase Compound ID 8gT8lClPhMb
InChI InChI=1S/C6H9NOS/c1-2-4-7-6(8)3-5-9-7/h3,5H,2,4H2,1H3
InChIKey PXCPEUSDGQTUFR-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 3bVJ7mrwtCO
Name N-propylisothiazole-3(2H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9NOS
InChI InChI=1S/C6H9NOS/c1-2-4-7-6(8)3-5-9-7/h3,5H,2,4H2,1H3
InChIKey PXCPEUSDGQTUFR-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200100174
Molecular Weight 143.204 g/mol
SMILES C1(N(SC=C1)CCC)=O
SPLASH splash10-0udi-1900000000-1a80f7f86e7449daaf66
Source of Spectrum QA-48-1187-5a
Synonyms 2-Propylisothiazol-3(2H)-one
Wiley ID 1795527