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6,13-DIOXO-14,15-NOR-LABDA-7-ENE
SpectraBase Compound ID 85bQyRSqtwS
InChI InChI=1S/C18H28O2/c1-12-11-15(20)16-17(3,4)9-6-10-18(16,5)14(12)8-7-13(2)19/h11,14,16H,6-10H2,1-5H3/t14-,16-,18+/m0/s1
InChIKey NDTDEVRGTYZRRA-QILLFSRXSA-N
Mol Weight 276.42 g/mol
Molecular Formula C18H28O2
Exact Mass 276.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LyPt0E4PLlU
Name (+)-(4S,4aR,8aS)-3,4a,8,8-Tetramethyl-4-(3-oxobutyl)-4a,5,6,7,8,8a-hexahydro-1(4H)-naphthalenone
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Formula C18H28O2
InChI InChI=1S/C18H28O2/c1-12-11-15(20)16-17(3,4)9-6-10-18(16,5)14(12)8-7-13(2)19/h11,14,16H,6-10H2,1-5H3/t14-,16-,18+/m0/s1
InChIKey NDTDEVRGTYZRRA-QILLFSRXSA-N
Molecular Weight 276.420 g/mol
SMILES [C@]12([C@@](C(=O)C=C([C@@]2(CCC(=O)C)[H])C)(C(C)(C)CCC1)[H])C
SPLASH splash10-00di-9200000000-9970eadffe1f89c7200c
Source of Spectrum KC-57-5672-24
Synonyms (4S,4aR,8aS)-3,4a,8,8-tetramethyl-4-(3-oxobutyl)-4a,5,6,7,8,8a-hexahydro-1(4H)-naphthalenone
Wiley ID 1624846