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METHYL-4-O-CROTONYLSHIKIMATE

View entire compound with spectra: 1 NMR

METHYL-4-O-CROTONYLSHIKIMATE
SpectraBase Compound ID C3HHZDbJ9wu
InChI InChI=1S/C12H16O6/c1-3-4-10(15)18-11-8(13)5-7(6-9(11)14)12(16)17-2/h3-5,8-9,11,13-14H,6H2,1-2H3/b4-3+/t8-,9-,11-/m1/s1
InChIKey SBRMSZVSCHVGMV-NCOROSKWSA-N
Mol Weight 256.25 g/mol
Molecular Formula C12H16O6
Exact Mass 256.094688 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BuWkssnxXaP
Name METHYL-4-O-CROTONYLSHIKIMATE
Compound Number 8I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O6
InChI InChI=1S/C12H16O6/c1-3-4-10(15)18-11-8(13)5-7(6-9(11)14)12(16)17-2/h3-5,8-9,11,13-14H,6H2,1-2H3/b4-3+/t8-,9-,11-/m1/s1
InChIKey SBRMSZVSCHVGMV-NCOROSKWSA-N
Literature Reference Author N.ARMESTO,M.FERRERO,S.FERNANDEZ,V.GOTOR
Literature Reference Citation J.ORG.CHEM.,67,4978(2002)
Literature Reference DOI 10.1021/jo025671p
Molecular Weight 256.255 g/mol
Solvent CDCl3
Source File Reference UWVN23404