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4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-2-methylene-butanal
SpectraBase Compound ID B9EOHJyxQiK
InChI InChI=1S/C19H30O/c1-14(13-20)7-9-16-15(2)8-10-17-18(3,4)11-6-12-19(16,17)5/h13,16-17H,1-2,6-12H2,3-5H3/t16-,17-,19+/m0/s1
InChIKey VFNUWLYWQCMULB-JENIJYKNSA-N
Mol Weight 274.45 g/mol
Molecular Formula C19H30O
Exact Mass 274.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5qnpNMDogC
Name 4-[(1S,4aS,8aS)-5,5,8a-trimethyl-2-methylene-decalin-1-yl]-2-methylene-butanal
Appearance Pale yellow gum
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Formula C19H30O
InChI InChI=1S/C19H30O/c1-14(13-20)7-9-16-15(2)8-10-17-18(3,4)11-6-12-19(16,17)5/h13,16-17H,1-2,6-12H2,3-5H3/t16-,17-,19+/m0/s1
InChIKey VFNUWLYWQCMULB-JENIJYKNSA-N
Instrument Name JEOL JMS-AX505HA
Ionization Type EI
Literature Reference DOI 10.1021/np500688c
Molecular Weight 274.448 g/mol
SMILES C1C[C@]2([C@](C(C1)(C)C)(CCC([C@@]2(CCC(C=O)=C)[H])=C)[H])C
SPLASH splash10-053m-9800000000-731bd1983d41d7024a60
Source of Spectrum G4-78-206-10
Wiley ID 1865835