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NKPTVQFJWGCELJ-UHFFFAOYSA-N
SpectraBase Compound ID 1zByrQCuknu
InChI InChI=1S/C8H8O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2
InChIKey NKPTVQFJWGCELJ-UHFFFAOYSA-N
Mol Weight 168.21 g/mol
Molecular Formula C8H8O2S
Exact Mass 168.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2spc7feUCm
Name Benzo[b]thiophene, 2,3-dihydro-, 1,1-dioxide
Alternate Name(s) 1-Thiaindan 1,1-dioxide 2,3-Dihydro-1-benzothiophene 1,1-dioxide 2,3-Dihydrobenzothiophene 1,1-dioxide 2,3-Dihydrobenzo[b]thiophene 1,1-dioxide
CAS Registry Number 14315-13-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O2S
InChI InChI=1S/C8H8O2S/c9-11(10)6-5-7-3-1-2-4-8(7)11/h1-4H,5-6H2
InChIKey NKPTVQFJWGCELJ-UHFFFAOYSA-N
Molecular Weight 168.210 g/mol
SMILES c12S(=O)(=O)CCc1cccc2
SPLASH splash10-0gb9-3900000000-8000268d3bc465646648
Source of Spectrum T-67-927-0
Wiley ID 1164063