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(2Z)-2-(2-keto-7a-methyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-ylidene)acetic acid methyl ester
SpectraBase Compound ID A5JwUx3R6H9
InChI InChI=1S/C12H16O4/c1-12-6-4-3-5-9(12)8(11(14)16-12)7-10(13)15-2/h7,9H,3-6H2,1-2H3/b8-7-
InChIKey OLQQKEWSROOQRK-FPLPWBNLSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HhPAgk8VuNt
Name (2Z)-2-(2-keto-7a-methyl-4,5,6,7-tetrahydro-3aH-benzofuran-3-ylidene)acetic acid methyl ester
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-12-6-4-3-5-9(12)8(11(14)16-12)7-10(13)15-2/h7,9H,3-6H2,1-2H3/b8-7-
InChIKey OLQQKEWSROOQRK-FPLPWBNLSA-N
Literature Reference Author A.W.HANSON,A.W.MCCULLOCH,A.G.MCINNES
Literature Reference Citation CAN.J.CHEM.,59,288(1981)
Literature Reference DOI 10.1139/v81-047
Molecular Weight 224.257 g/mol
Solvent CDCl3
Source File Reference UWED5110