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(3R,4R,6'S)-4,6'-dimethyl-1'-spiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclohexane]one
SpectraBase Compound ID HvNoxqvndmx
InChI InChI=1S/C19H30O/c1-14-8-7-12-19(18(14)20)13-11-16-9-5-3-4-6-10-17(16)15(19)2/h14-15H,3-13H2,1-2H3/t14-,15+,19+/m0/s1
InChIKey ZHXAVVMTIIEFAJ-QMTMVMCOSA-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 9UTd4TtMYo4
Name (3R,4R,6'S)-4,6'-dimethyl-1'-spiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclohexane]one
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Formula C19H30O
InChI InChI=1S/C19H30O/c1-14-8-7-12-19(18(14)20)13-11-16-9-5-3-4-6-10-17(16)15(19)2/h14-15H,3-13H2,1-2H3/t14-,15+,19+/m0/s1
InChIKey ZHXAVVMTIIEFAJ-QMTMVMCOSA-N
Molecular Weight 274.448 g/mol
SMILES [C@@]12([C@@](C=3CCCCCCC3CC2)(C)[H])C(=O)[C@@](C)(CCC1)[H]
SPLASH splash10-0adl-7950000000-6d160fce327183b80b91
Source of Spectrum F4-0-2221-16
Synonyms (3R,4R,6'S)-4,6'-dimethylspiro[2,4,5,6,7,8,9,10-octahydro-1H-benzocyclooctene-3,2'-cyclohexane]-1'-one (3R,4R,6'S)-4,6'-dimethylspiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclohexane]-1'-one
Wiley ID 1620112