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1-Cyclohexeno[2,3-b]cholestan-1'-one
SpectraBase Compound ID 2SuVOuc7seO
InChI InChI=1S/C31H50O/c1-20(2)9-8-10-21(3)26-15-16-27-25-14-13-23-19-22-11-6-7-12-24(22)29(32)31(23,5)28(25)17-18-30(26,27)4/h12,20-23,25-28H,6-11,13-19H2,1-5H3
InChIKey CFNNZQCUBAFDRT-UHFFFAOYSA-N
Mol Weight 438.7 g/mol
Molecular Formula C31H50O
Exact Mass 438.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 41ImLfsyqrt
Name
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Formula C31H50O
InChI InChI=1S/C31H50O/c1-20(2)9-8-10-21(3)26-15-16-27-25-14-13-23-19-22-11-6-7-12-24(22)29(32)31(23,5)28(25)17-18-30(26,27)4/h12,20-23,25-28H,6-11,13-19H2,1-5H3
InChIKey CFNNZQCUBAFDRT-UHFFFAOYSA-N
Molecular Weight 438.3849
SMILES C1CCC2C(C(=O)C3(C)C(CCC4C3CCC3(C)C4CCC3C(C)CCCC(C)C)C2)=C1
SPLASH splash10-03di-3910100000-65a34ffe4d81a59de782
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany