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1-Ethyl-6-methyl-3H-1.lambda.4-benzo[d]isothiazole 1-oxide
SpectraBase Compound ID JZwCAfSudAu
InChI InChI=1S/C10H13NOS/c1-3-13(12)10-6-8(2)4-5-9(10)7-11-13/h4-6H,3,7H2,1-2H3
InChIKey XRUKKCSOGZALTL-UHFFFAOYSA-N
Mol Weight 195.28 g/mol
Molecular Formula C10H13NOS
Exact Mass 195.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6noZc2P8aPI
Name 1-Ethyl-6-methyl-3H-1.lambda.4-benzo[d]isothiazole 1-oxide
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 195.071785216 u
Formula C10H13NOS
InChI InChI=1S/C10H13NOS/c1-3-13(12)10-6-8(2)4-5-9(10)7-11-13/h4-6H,3,7H2,1-2H3
InChIKey XRUKKCSOGZALTL-UHFFFAOYSA-N
Instrument Name Finnigan SSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/anie.201804284
Molecular Weight 195.280 g/mol
Reported Formula C10H13NOS
SMILES C1=CC2=C(C=C1C)S(=NC2)(CC)=O
SPLASH splash10-00dj-1900000000-81ccb19a3e1bce9fb557
Source of Spectrum ACI-57-SM17-4e (DOI: 10.1002/anie.201804284)
Thin-Layer Chromatography 0.33 (EtOAc/MeOH, 10:1)
Wiley ID 1893368