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(CIS)-METHYL-3-[3',4'-(METHYLENEDIOXY)-PHENYL]-2-METHYL-GLYCINATE
SpectraBase Compound ID Alg2iUTMz9Q
InChI InChI=1S/C12H12O5/c1-12(11(13)14-2)10(17-12)7-3-4-8-9(5-7)16-6-15-8/h3-5,10H,6H2,1-2H3/t10-,12-/m0/s1
InChIKey NEWFBAYQRLTJTP-JQWIXIFHSA-N
Mol Weight 236.22 g/mol
Molecular Formula C12H12O5
Exact Mass 236.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CC5Ao5cY89q
Name (CIS)-METHYL-3-[3',4'-(METHYLENEDIOXY)-PHENYL]-2-METHYL-GLYCINATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O5
InChI InChI=1S/C12H12O5/c1-12(11(13)14-2)10(17-12)7-3-4-8-9(5-7)16-6-15-8/h3-5,10H,6H2,1-2H3/t10-,12-/m0/s1
InChIKey NEWFBAYQRLTJTP-JQWIXIFHSA-N
Literature Reference Author M.COLLINS,A.HEAGNEY,F.CORDARO,D.ODGERS,G.TARRANT,S.STEWART
Literature Reference Citation J.FORENSIC.SCI.,52,898(2007)
Literature Reference DOI 10.1111/j.1556-4029.2007.00480.x
Molecular Weight 236.224 g/mol
Sample ID 68768
Solvent CDCl3