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(5R,7S,9R,10S)-2-Oxocadinan-3,6(11)-dien-12,7-olide

View entire compound with spectra: 1 MS (GC)

(5R,7S,9R,10S)-2-Oxocadinan-3,6(11)-dien-12,7-olide
SpectraBase Compound ID FPKtWjzzy7S
InChI InChI=1S/C15H18O3/c1-7-5-13-14(9(3)15(17)18-13)11-4-8(2)12(16)6-10(7)11/h4,7,10-11,13H,5-6H2,1-3H3/t7-,10+,11+,13?/m1/s1
InChIKey JCTYUEGJVULBEI-GNOWCWRTSA-N
Mol Weight 246.31 g/mol
Molecular Formula C15H18O3
Exact Mass 246.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2R5YixdounA
Name (5R,7S,9R,10S)-2-Oxocadinan-3,6(11)-dien-12,7-olide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O3
InChI InChI=1S/C15H18O3/c1-7-5-13-14(9(3)15(17)18-13)11-4-8(2)12(16)6-10(7)11/h4,7,10-11,13H,5-6H2,1-3H3/t7-,10+,11+,13?/m1/s1
InChIKey JCTYUEGJVULBEI-GNOWCWRTSA-N
Molecular Weight 246.306 g/mol
SMILES C1=2[C@]3(C=C(C)C(C[C@]3([C@](C)(CC1OC(C2C)=O)[H])[H])=O)[H]
SPLASH splash10-0f7a-0950000000-67561d150cda8cc0d36c
Source of Spectrum G4-71-1488-1
Wiley ID 1695071