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Abieta-(8(14),13(15)-diene
SpectraBase Compound ID JKvGrpVVpsQ
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h13,17-18H,6-12H2,1-5H3/t17-,18-,20+/m0/s1
InChIKey MRRHSEMHYVQUFK-CMKODMSKSA-N
Mol Weight 272.5 g/mol
Molecular Formula C20H32
Exact Mass 272.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BzOCMIAII1
Name (4aS,4bS,10aS)-7-isopropylidene-1,1,4a-trimethyl-3,4,4b,5,6,9,10,10a-octahydro-2H-phenanthrene
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Formula C20H32
InChI InChI=1S/C20H32/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h13,17-18H,6-12H2,1-5H3/t17-,18-,20+/m0/s1
InChIKey MRRHSEMHYVQUFK-CMKODMSKSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 272.476 g/mol
SMILES C1CC([C@]2([C@](C1)([C@@]1(C(CC2)=CC(CC1)=C(C)C)[H])C)[H])(C)C
SPLASH splash10-0079-1940000000-457ad941c6d147595f3a
Source of Spectrum US20110111457A1
Wiley ID 1870363