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2-ACETYL-3-BETA-METHYL-3A,4,5,6,7,7A-HEXAHYDROINDEN-4-BETA-CARBOXYLIC-ACID-METHYLESTER
SpectraBase Compound ID 9Sj3DZaOddU
InChI InChI=1S/C14H20O3/c1-9(15)10-7-11-5-4-6-12(13(16)17-3)14(11,2)8-10/h8,11-12H,4-7H2,1-3H3/t11-,12-,14+/m0/s1
InChIKey QQRBZSIGFUEPRF-SGMGOOAPSA-N
Mol Weight 236.31 g/mol
Molecular Formula C14H20O3
Exact Mass 236.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8BKzYA8jaQN
Name 2-ACETYL-3-BETA-METHYL-3A,4,5,6,7,7A-HEXAHYDROINDEN-4-BETA-CARBOXYLIC-ACID-METHYLESTER
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H20O3
InChI InChI=1S/C14H20O3/c1-9(15)10-7-11-5-4-6-12(13(16)17-3)14(11,2)8-10/h8,11-12H,4-7H2,1-3H3/t11-,12-,14+/m0/s1
InChIKey QQRBZSIGFUEPRF-SGMGOOAPSA-N
Literature Reference Author Y.ZHAO,Z.JIA,H.PENG
Literature Reference Citation J.NAT.PROD.,58,1358(1995)
Literature Reference DOI 10.1021/np50123a004
Molecular Weight 236.311 g/mol
Solvent DMSO-D6
Source File Reference UWCS22671