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(E)-3-Methyl-5-(3,4,8,8-tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-pent-2-enoic acid methyl ester
SpectraBase Compound ID JVK7P50BfyY
InChI InChI=1S/C21H30O2/c1-14(12-20(22)23-6)9-10-17-13-19-18(16(3)15(17)2)8-7-11-21(19,4)5/h12-13H,7-11H2,1-6H3/b14-12+
InChIKey WSYAZOHBJKFHBG-WYMLVPIESA-N
Mol Weight 314.47 g/mol
Molecular Formula C21H30O2
Exact Mass 314.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Btyv0bs3Wll
Name (E)-3-Methyl-5-(3,4,8,8-tetramethyl-5,6,7,8-tetrahydro-naphthalen-2-yl)-pent-2-enoic acid methyl ester
Alternate Name(s) Methyl 13E-isofregeneden-15-oate
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Formula C21H30O2
InChI InChI=1S/C21H30O2/c1-14(12-20(22)23-6)9-10-17-13-19-18(16(3)15(17)2)8-7-11-21(19,4)5/h12-13H,7-11H2,1-6H3/b14-12+
InChIKey WSYAZOHBJKFHBG-WYMLVPIESA-N
Molecular Weight 314.469 g/mol
SMILES c12c(c(C)c(c(c2)CC\C(=C\C(=O)OC)C)C)CCCC1(C)C
SPLASH splash10-0pvu-6941000000-abe1ed5f2fd520003925
Source of Spectrum F-59-2340-50
Wiley ID 1677529