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BRNMIIDEQOJZTP-UHFFFAOYSA-N
SpectraBase Compound ID 26XVIeoB6vB
InChI InChI=1S/C9H8O2S/c1-7-6-8-4-2-3-5-9(8)12(7,10)11/h2-6H,1H3
InChIKey BRNMIIDEQOJZTP-UHFFFAOYSA-N
Mol Weight 180.22 g/mol
Molecular Formula C9H8O2S
Exact Mass 180.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWF948xRM0L
Name Benzo[b]thiophene, 2-methyl-, 1,1-dioxide
Alternate Name(s) 2-Methyl-1-benzothiophene 1,1-dioxide 2-Methyl-benzo(b)thiophene-1,1-dioxide 2-Methylbenzothiophene 1,1-dioxide 2-Methylthianaphthene-1,1 dioxide Benzo[b]thiophene 1,1-dioxide,2-methyl-
CAS Registry Number 6224-55-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O2S
InChI InChI=1S/C9H8O2S/c1-7-6-8-4-2-3-5-9(8)12(7,10)11/h2-6H,1H3
InChIKey BRNMIIDEQOJZTP-UHFFFAOYSA-N
Molecular Weight 180.221 g/mol
SMILES CC1=Cc2ccccc2S1(=O)=O
SPLASH splash10-000i-4900000000-353c15549b73f5e6cbb0
Source of Spectrum W5-1989-9285-1
Wiley ID 1175887