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Cholest-2-eno[2,3-b]naphthalene, 8'-methyl-
SpectraBase Compound ID JmFO5YAfNwG
InChI InChI=1S/C36H52/c1-23(2)9-7-11-25(4)32-15-16-33-30-14-13-29-20-27-19-26-12-8-10-24(3)31(26)21-28(27)22-36(29,6)34(30)17-18-35(32,33)5/h8,10,12,19,21,23,25,29-30,32-34H,7,9,11,13-18,20,22H2,1-6H3
InChIKey QFOAHHVEBDSKEV-UHFFFAOYSA-N
Mol Weight 484.8 g/mol
Molecular Formula C36H52
Exact Mass 484.406902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUA2rvo2dz4
Name Cholest-2-eno[2,3-b]naphthalene, 8'-methyl-
Alternate Name(s) 1-(1,5-Dimethylhexyl)-11,13a,15a-trimethyl-2,3,3a,3b,4,5,5a,6,13,13a,13b,14,15,15a-tetradecahydro-1H-indeno[5,4-a]naphthacene
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Formula C36H52
InChI InChI=1S/C36H52/c1-23(2)9-7-11-25(4)32-15-16-33-30-14-13-29-20-27-19-26-12-8-10-24(3)31(26)21-28(27)22-36(29,6)34(30)17-18-35(32,33)5/h8,10,12,19,21,23,25,29-30,32-34H,7,9,11,13-18,20,22H2,1-6H3
InChIKey QFOAHHVEBDSKEV-UHFFFAOYSA-N
Molecular Weight 484.812 g/mol
SMILES C12C3(Cc4c(CC3CCC1C1C(C(CC1)C(CCCC(C)C)C)(CC2)C)cc1c(c4)c(ccc1)C)C
SPLASH splash10-001i-5741900000-c5a797949a0596481547
Wiley ID 1474945