For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
DCAZNDCIMXHKOS-UHFFFAOYSA-N
SpectraBase Compound ID 6K40IVuxFVD
InChI InChI=1S/C9H8O2S/c1-7-6-12(10,11)9-5-3-2-4-8(7)9/h2-6H,1H3
InChIKey DCAZNDCIMXHKOS-UHFFFAOYSA-N
Mol Weight 180.22 g/mol
Molecular Formula C9H8O2S
Exact Mass 180.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FIriH0piJxw
Name 3-Methylbenzo[b]thiophene 1,1-dioxide
Appearance White crystalline solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 180.024500670 u
Formula C9H8O2S
InChI InChI=1S/C9H8O2S/c1-7-6-12(10,11)9-5-3-2-4-8(7)9/h2-6H,1H3
InChIKey DCAZNDCIMXHKOS-UHFFFAOYSA-N
Instrument Name GCMSQP2010 SE
Ionization Type EI
Literature Reference DOI 10.1002/anie.201701409
Molecular Weight 180.221 g/mol
Quality 108
SMILES C1=CC2=C(C=C1)S(C=C2C)(=O)=O
SPLASH splash10-0udi-0900000000-13c69fe887a01d1e7bea
Source of Spectrum ACI-56-SM14-3g (DOI: 10.1002/anie.201701409)
Wiley ID 1895793