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2,5-Dimethyl-3H-2lambda4-benzo[c]isothiazole-2-oxide
SpectraBase Compound ID 3HHbvxqTBeI
InChI InChI=1S/C9H11NOS/c1-7-3-4-9-8(5-7)6-12(2,11)10-9/h3-5H,6H2,1-2H3
InChIKey SBAJTTALRCXELY-UHFFFAOYSA-N
Mol Weight 181.25 g/mol
Molecular Formula C9H11NOS
Exact Mass 181.056135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9wZAeVFgVSs
Name 2,5-Dimethyl-3H-2lambda4-benzo[c]isothiazole-2-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NOS
InChI InChI=1S/C9H11NOS/c1-7-3-4-9-8(5-7)6-12(2,11)10-9/h3-5H,6H2,1-2H3
InChIKey SBAJTTALRCXELY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600823
Molecular Weight 181.253 g/mol
SMILES c12N=S(Cc2cc(cc1)C)(=O)C
SPLASH splash10-00lr-0900000000-50a8f182a084975830f2
Source of Spectrum ASC-358-3649/SM12-3f
Synonyms 2,5-Dimethyl-3H-2lambda4-benzo[c]isothiazole 2-oxide
Wiley ID 1803478