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MONASCUSIC_ACID_B;3-(2,6-DIMETHYL-1,2,4A,5,6,7,8,8A-OCTAHYDRONAPHTHALEN-1-YL)-PROPENOIC_ACID

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MONASCUSIC_ACID_B;3-(2,6-DIMETHYL-1,2,4A,5,6,7,8,8A-OCTAHYDRONAPHTHALEN-1-YL)-PROPENOIC_ACID
SpectraBase Compound ID 9yfiN9y4roJ
InChI InChI=1S/C15H22O2/c1-10-3-6-14-12(9-10)5-4-11(2)13(14)7-8-15(16)17/h4-5,7-8,10-14H,3,6,9H2,1-2H3,(H,16,17)/b8-7+/t10-,11+,12+,13+,14+/m1/s1
InChIKey RUEMHNNYLHGNMT-HAGPYYNFSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GZkZ7qabNgU
Name MONASCUSIC_ACID_B;3-(2,6-DIMETHYL-1,2,4A,5,6,7,8,8A-OCTAHYDRONAPHTHALEN-1-YL)-PROPENOIC_ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-10-3-6-14-12(9-10)5-4-11(2)13(14)7-8-15(16)17/h4-5,7-8,10-14H,3,6,9H2,1-2H3,(H,16,17)/b8-7+/t10-,11+,12+,13+,14+/m1/s1
InChIKey RUEMHNNYLHGNMT-HAGPYYNFSA-N
Literature Reference Author L.ZHU,J.G.LU,T.LI,G.Y.ZHU,Q.B.HAN,W.L.HSIAO,L.LIU,Z.H.JIANG
Literature Reference Citation J.NAT.PROD.,75,567(2012)
Literature Reference DOI 10.1021/np2007236
Molecular Weight 234.338 g/mol
Sample ID 40236
Solvent DMSO-D6