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4-METHOXY-BENZENECARBOTHIOIC-ACID
SpectraBase Compound ID CRTlYz97dbY
InChI InChI=1S/C8H8O2S/c1-10-7-4-2-6(3-5-7)8(9)11/h2-5H,1H3,(H,9,11)
InChIKey YGAPOICUMNPIPF-UHFFFAOYSA-N
Mol Weight 168.21 g/mol
Molecular Formula C8H8O2S
Exact Mass 168.024501 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BpzcNLVDvEe
Name 4-METHOXY-BENZENETHIOCARBOXYLIC-ACID
Compound Number 1D'
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8O2S
InChI InChI=1S/C8H8O2S/c1-10-7-4-2-6(3-5-7)8(9)11/h2-5H,1H3,(H,9,11)
InChIKey YGAPOICUMNPIPF-UHFFFAOYSA-N
Literature Reference Author S.KATO,Y.KAWAHARA,H.KAGEYAMA,R.YAMADA,O.NIYOMURA,T.MURAI,T.K ANDA
Literature Reference Citation J.AM.CHEM.SOC.,118,1262(1996)
Literature Reference DOI 10.1021/ja953035l
Molecular Weight 168.210 g/mol
Sample ID 38366
Solvent ACETONE-D6