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(+/-)-(4aS,8aR,10aR)-1,1,4a,8a-Tetramethyl-3,4,4a,6,7,8,8a,9,10,10a-decahydrophenanthren-2(1H)-one
SpectraBase Compound ID 82WHC1arr75
InChI InChI=1S/C18H28O/c1-16(2)13-8-11-17(3)10-6-5-7-14(17)18(13,4)12-9-15(16)19/h7,13H,5-6,8-12H2,1-4H3/t13-,17+,18-/m0/s1
InChIKey NFPOCLBTJGPNIS-VHSSKADRSA-N
Mol Weight 260.42 g/mol
Molecular Formula C18H28O
Exact Mass 260.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fflsqkd72tR
Name (+/-)-(4aS,8aR,10aR)-1,1,4a,8a-Tetramethyl-3,4,4a,6,7,8,8a,9,10,10a-decahydrophenanthren-2(1H)-one
Appearance Semisolid
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Formula C18H28O
InChI InChI=1S/C18H28O/c1-16(2)13-8-11-17(3)10-6-5-7-14(17)18(13,4)12-9-15(16)19/h7,13H,5-6,8-12H2,1-4H3/t13-,17+,18-/m0/s1
InChIKey NFPOCLBTJGPNIS-VHSSKADRSA-N
Literature Reference DOI 10.1021/jm101445p
Molecular Weight 260.421 g/mol
Reported Formula C18H28O
SMILES C1C(C([C@]2([C@](C1)(C=1[C@@](CC2)(CCCC1)C)C)[H])(C)C)=O
SPLASH splash10-056s-0950000000-6969a625a006f0f8d95c
Source of Spectrum AF-54-SM39-48, (+/-)-48
Wiley ID 1848779