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5-Methoxy-2-methyl-3H-2lambda4-benzo[c]isothiazole-2-oxide
SpectraBase Compound ID HJXLWMq74XS
InChI InChI=1S/C9H11NO2S/c1-12-8-3-4-9-7(5-8)6-13(2,11)10-9/h3-5H,6H2,1-2H3
InChIKey WHXSMTWQIKJVFL-UHFFFAOYSA-N
Mol Weight 197.25 g/mol
Molecular Formula C9H11NO2S
Exact Mass 197.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CVaj2scqnp
Name 5-Methoxy-2-methyl-3H-2lambda4-benzo[c]isothiazole-2-oxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11NO2S
InChI InChI=1S/C9H11NO2S/c1-12-8-3-4-9-7(5-8)6-13(2,11)10-9/h3-5H,6H2,1-2H3
InChIKey WHXSMTWQIKJVFL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201600823
Molecular Weight 197.252 g/mol
SMILES c12N=S(Cc2cc(cc1)OC)(=O)C
SPLASH splash10-001i-0900000000-f2a785252e74e66efc03
Source of Spectrum ASC-358-3649/SM13-3i
Synonyms 5-Methoxy-2-methyl-3H-2lambda4-benzo[c]isothiazole 2-oxide
Wiley ID 1803481