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D-Homo-5.alpha.-androstan-3-one, 5,8,17a.beta.-trimethyl-, cyclic ethylene acetal
SpectraBase Compound ID JVcIjBSca4E
InChI InChI=1S/C25H42O2/c1-18-7-6-8-19-22(18,3)10-9-20-23(19,4)12-11-21(2)17-25(26-15-16-27-25)14-13-24(20,21)5/h18-20H,6-17H2,1-5H3
InChIKey VSXWBTROOKAQQL-UHFFFAOYSA-N
Mol Weight 374.6 g/mol
Molecular Formula C25H42O2
Exact Mass 374.318481 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXTugbTdhGt
Name D-Homo-5.alpha.-androstan-3-one, 5,8,17A.beta.-trimethyl-, cyclic ethylene acetal
Comments Computed using HOSE algorithm
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Exact Mass 374.318480590 u
Formula C25H42O2
InChI InChI=1S/C25H42O2/c1-18-7-6-8-19-22(18,3)10-9-20-23(19,4)12-11-21(2)17-25(26-15-16-27-25)14-13-24(20,21)5/h18-20H,6-17H2,1-5H3
InChIKey VSXWBTROOKAQQL-UHFFFAOYSA-N
Molecular Weight 374.609 g/mol
SMILES C12(C)C3C(C)(C4C(CC3)(C)C(C)CCC4)CCC2(C)CC2(CC1)OCCO2