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BRNMIIDEQOJZTP-UHFFFAOYSA-N

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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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID B5xKYyKFbMe
Name 2-METHYLBENZO[b]THIOPHENE, 1,1-DIOXIDE
Source of Sample P. Geneste, J. L. Olive J. Org. Chem. 44, 2887(1979)
Copyright Copyright © 1980, 1981-2024 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 180.23
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms BENZO/B/THIOPHENE, 2-METHYL-, 1,1-DIOXIDE