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METHYL-2-METHOXYCARBONYLETHYLENE-2-ISOTHIOCYANATOCARBOXYLATE
SpectraBase Compound ID qwTvBBZ7Op
InChI InChI=1S/C8H11NO4S/c1-12-7(10)4-3-6(9-5-14)8(11)13-2/h6H,3-4H2,1-2H3
InChIKey KLMJCPVACFOOCU-UHFFFAOYSA-N
Mol Weight 217.24 g/mol
Molecular Formula C8H11NO4S
Exact Mass 217.040879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqHs7w72jN5
Name METHYL-2-METHOXYCARBONYLETHYLENE-2-ISOTHIOCYANATOCARBOXYLATE
Compound Number 1F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H11NO4S
InChI InChI=1S/C8H11NO4S/c1-12-7(10)4-3-6(9-5-14)8(11)13-2/h6H,3-4H2,1-2H3
InChIKey KLMJCPVACFOOCU-UHFFFAOYSA-N
Literature Reference Author L.FLOCH,V.OREMUS,M.KOVACS
Literature Reference Citation MOLECULES,4,279(1999)
Literature Reference DOI 10.3390/41000279
Molecular Weight 217.240 g/mol
Solvent CDCl3
Source File Reference UWVN7141