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2-CARBOXYMETHYL-4-METHOXY-6-METHYLBENZOIC_ACID
SpectraBase Compound ID 3fEU0f7150W
InChI InChI=1S/C11H12O5/c1-6-3-8(16-2)4-7(5-9(12)13)10(6)11(14)15/h3-4H,5H2,1-2H3,(H,12,13)(H,14,15)
InChIKey KHDOZKPPKYCPPN-UHFFFAOYSA-N
Mol Weight 224.21 g/mol
Molecular Formula C11H12O5
Exact Mass 224.068473 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IKNIyxYLD49
Name 2-CARBOXYMETHYL-4-METHOXY-6-METHYLBENZOIC_ACID
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H12O5
InChI InChI=1S/C11H12O5/c1-6-3-8(16-2)4-7(5-9(12)13)10(6)11(14)15/h3-4H,5H2,1-2H3,(H,12,13)(H,14,15)
InChIKey KHDOZKPPKYCPPN-UHFFFAOYSA-N
Literature Reference Author P.MARTIN,S.RODIER,M.MONDON,B.RENOUX,B.PFEIFFER,P.RENARD,A.PI ERRE,J.P.GESSON
Literature Reference Citation BIOORG.MED.CHEM.,10,253(2002)
Literature Reference DOI 10.1016/S0968-0896(01)00273-5
Molecular Weight 224.213 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ22120