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YYJWBYNQJLBIGS-SNAWJCMRSA-N
SpectraBase Compound ID 5OuykQAG7Am
InChI InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+
InChIKey YYJWBYNQJLBIGS-SNAWJCMRSA-N
Mol Weight 114.14 g/mol
Molecular Formula C6H10O2
Exact Mass 114.06808 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kq4F3q0GiAY
Name TIGLIC-ACID-METHYLESTER
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H10O2
InChI InChI=1S/C6H10O2/c1-4-5(2)6(7)8-3/h4H,1-3H3/b5-4+
InChIKey YYJWBYNQJLBIGS-SNAWJCMRSA-N
Literature Reference Author X.N.ZHONG,H.OTSUKA,T.IDE,E.HIRATA,Y.TAKEDA
Literature Reference Citation PHYTOCHEM.,52,923(1999)
Literature Reference DOI 10.1016/S0031-9422(99)00334-9
Molecular Weight 114.144 g/mol
Solvent CD3OD
Source File Reference UWVN413