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3-Oxo-18-nor-abieta-8,11,13-triene
SpectraBase Compound ID 44KRxgPnNEx
InChI InChI=1S/C19H26O/c1-12(2)14-5-8-17-15(11-14)6-7-16-13(3)18(20)9-10-19(16,17)4/h5,8,11-13,16H,6-7,9-10H2,1-4H3/t13-,16+,19+/m1/s1
InChIKey PMZSHMPETRKMLW-AZOIQLNYSA-N
Mol Weight 270.42 g/mol
Molecular Formula C19H26O
Exact Mass 270.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 67Bd7PCqm
Name 3-Oxo-18-nor-abieta-8,11,13-triene
Alternate Name(s) (1R,4aS,10aS)-7-isopropyl-1,4a-dimethyl-3,4,4a,9,10,10a-hexahydro-2(1H)-phenanthrenone
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Formula C19H26O
InChI InChI=1S/C19H26O/c1-12(2)14-5-8-17-15(11-14)6-7-16-13(3)18(20)9-10-19(16,17)4/h5,8,11-13,16H,6-7,9-10H2,1-4H3/t13-,16+,19+/m1/s1
InChIKey PMZSHMPETRKMLW-AZOIQLNYSA-N
Molecular Weight 270.416 g/mol
SMILES [C@@]12([C@]([C@](C)([H])C(CC2)=O)(CCc2c1ccc(C(C)C)c2)[H])C
SPLASH splash10-0c00-0590000000-7bda1ab51a586ca01864
Source of Spectrum X2-56-1463-12
Wiley ID 1605013