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2-Ethylbenzo[b]thiophene 1,1-dioxide
SpectraBase Compound ID sRBuhL6i8g
InChI InChI=1S/C10H10O2S/c1-2-9-7-8-5-3-4-6-10(8)13(9,11)12/h3-7H,2H2,1H3
InChIKey ODKDZCLRYADENB-UHFFFAOYSA-N
Mol Weight 194.25 g/mol
Molecular Formula C10H10O2S
Exact Mass 194.040151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wpT1KRrGza
Name 2-Ethylbenzo[b]thiophene 1,1-dioxide
Appearance White crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O2S
InChI InChI=1S/C10H10O2S/c1-2-9-7-8-5-3-4-6-10(8)13(9,11)12/h3-7H,2H2,1H3
InChIKey ODKDZCLRYADENB-UHFFFAOYSA-N
Instrument Name GCMSQP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701409
Molecular Weight 194.248 g/mol
Quality 145
SMILES C1=CC2=C(C=C1)S(C(=C2)CC)(=O)=O
SPLASH splash10-002r-0900000000-a9a014f28ca52c37b3e8
Source of Spectrum ACI-56-SM12-3b (DOI: 10.1002/anie.201701409)
Thin-Layer Chromatography 0.26 (pentane/EtOAc, 75:25)
Wiley ID 1895789