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Benzyl 2-Oxo-14-(2-propenyl)-3,7,11-trimethyl-6,10-cyclotetradecadien-1-yl Ether isomer
SpectraBase Compound ID 86Xg8JaDcSX
InChI InChI=1S/C27H38O2/c1-5-11-25-19-18-22(3)13-9-12-21(2)14-10-15-23(4)26(28)27(25)29-20-24-16-7-6-8-17-24/h5-8,11,13-14,16-17,23,25,27H,9-10,12,15,18-20H2,1-4H3/b11-5+,21-14+,22-13+
InChIKey HLBNFAVCJQVQIT-ZGZUXAEDSA-N
Mol Weight 394.6 g/mol
Molecular Formula C27H38O2
Exact Mass 394.28718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7SPUI23yB1Z
Name Benzyl 2-Oxo-14-(2-propenyl)-3,7,11-trimethyl-6,10-cyclotetradecadien-1-yl Ether isomer
Comments Less than 3 mono-isotopic peaks
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Formula C27H38O2
InChI InChI=1S/C27H38O2/c1-5-11-25-19-18-22(3)13-9-12-21(2)14-10-15-23(4)26(28)27(25)29-20-24-16-7-6-8-17-24/h5-8,11,13-14,16-17,23,25,27H,9-10,12,15,18-20H2,1-4H3/b11-5+,21-14+,22-13+
InChIKey HLBNFAVCJQVQIT-ZGZUXAEDSA-N
Molecular Weight 394.599 g/mol
SMILES C1(C(OCc2ccccc2)C(\C=C\C)CC\C(=C\CC\C(=C\CCC1C)C)C)=O
SPLASH splash10-0006-9000000000-fe90e775d8fd217999d3
Source of Spectrum J-56-4524-13
Synonyms 14-(benzyloxy)-2,6,10-trimethyl-13-[(1E)-1-propenyl]-5,9-cyclotetradecadien-1-one
Wiley ID 1366890