John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=81ZAb2pXKKk SpectraBase Spectrum ID=8KhM3TlS8CW

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3-HYDROXYTHIOCROTONIC ACID, O-ETHYL ESTER
SpectraBase Compound ID 81ZAb2pXKKk
InChI InChI=1S/C6H10O2S/c1-3-8-6(9)4-5(2)7/h4,7H,3H2,1-2H3/b5-4+
InChIKey XZGFTFBEBIIUOF-SNAWJCMRSA-N
Mol Weight 146.2 g/mol
Molecular Formula C6H10O2S
Exact Mass 146.040151 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8KhM3TlS8CW
Name 3-HYDROXYTHIOCROTONIC ACID, O-ETHYL ESTER
Source of Sample A. J. Bridges, G. H. Witham J. Chem. Soc. Perkin Trans. I, 1975, 1603
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H10O2S
InChI InChI=1S/C6H10O2S/c1-3-8-6(9)4-5(2)7/h4,7H,3H2,1-2H3/b5-4+
InChIKey XZGFTFBEBIIUOF-SNAWJCMRSA-N
Molecular Weight 146.21
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
SpectraBase Batch ID CNvYkeVYhZ4
Synonyms CROTONIC ACID, 3-HYDROXYTHIO-, O-ETHYL ESTER