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Cholest-2-eno[2,3-b]naphthalene, 8'-methyl-
SpectraBase Compound ID 9IRl3gWjazQ
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/t25-,29?,30+,32-,33+,34+,35-,36+/m1/s1
InChIKey QFOAHHVEBDSKEV-HMXRWAGOSA-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 5Xz8z2TfvUT
Name CHOLEST-2-ENO[2,3-B]NAPHTHALENE, 8'-METHYL-
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 484.406901674 u
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/t25-,29?,30+,32-,33+,34+,35-,36+/m1/s1
InChIKey QFOAHHVEBDSKEV-HMXRWAGOSA-N
Molecular Weight 484.812 g/mol
Nominal Mass 484 u
Number of Peaks 280
SMILES c12c(C[C@@]3([C@]4(CC[C@@]5([C@](CC[C@]5([C@@]4(CCC3C2)[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C)cc2c(c1)cccc2C
SPLASH splash10-001i-5741900000-d4c2796f3a2e6d1bfe62
Source File Reference LMCM-60559-007K
Synonyms 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 (14S,15S,18R,19R,22S,23R)-9,14,18-trimethyl-19-[(2R)-6-methylheptan-2-yl]hexacyclo[12.11.0.0(3,12).0(5,10).0(15,23).0(18,22)]pentacosa-3(12),4,6,8,10-pentaene (1R,3aS,3bR,13aS,13bS,15aR)-11,13a,15a-trimethyl-1-((R)-6-methylheptan-2-yl)-2,3,3a,3b,4,5,5a,6,13,13a,13b,14,15,15a-tetradecahydro-1H-indeno[5,4-a]tetracene
Wiley ID 8_8279