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Ethyl 1,2,3,4,4a,4b,5,6,8a,9,10,10a-dodecahydro-9-hydroxy-1,4a-dimethyl-7-(1'-methylethyl)-1-(methoxycarbonyl)phenanthrene-9.alpha.-yl ethanoate

View entire compound with spectra: 1 MS (GC)

Ethyl 1,2,3,4,4a,4b,5,6,8a,9,10,10a-dodecahydro-9-hydroxy-1,4a-dimethyl-7-(1'-methylethyl)-1-(methoxycarbonyl)phenanthrene-9.alpha.-yl ethanoate
SpectraBase Compound ID EFE4Rzr0gfN
InChI InChI=1S/C25H40O5/c1-7-30-21(26)15-25(28)14-20-23(4,11-8-12-24(20,5)22(27)29-6)18-10-9-17(16(2)3)13-19(18)25/h13,16,18-20,28H,7-12,14-15H2,1-6H3/t18?,19?,20?,23?,24?,25-/m1/s1
InChIKey DVHYTYWKPDQDCE-MNEHUGDVSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMssPPwL8k
Name Ethyl 1,2,3,4,4a,4b,5,6,8a,9,10,10a-dodecahydro-9-hydroxy-1,4a-dimethyl-7-(1'-methylethyl)-1-(methoxycarbonyl)phenanthrene-9.alpha.-yl ethanoate
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Formula C25H40O5
InChI InChI=1S/C25H40O5/c1-7-30-21(26)15-25(28)14-20-23(4,11-8-12-24(20,5)22(27)29-6)18-10-9-17(16(2)3)13-19(18)25/h13,16,18-20,28H,7-12,14-15H2,1-6H3/t18?,19?,20?,23?,24?,25-/m1/s1
InChIKey DVHYTYWKPDQDCE-MNEHUGDVSA-N
Molecular Weight 420.590 g/mol
SMILES O[C@@]1(C2C(C3(CCCC(C3C1)(C(=O)OC)C)C)CCC(=C2)C(C)C)CC(=O)OCC
SPLASH splash10-0udi-0003900000-8e8332c58fb10295edb2
Source of Spectrum AH-129-926-6
Wiley ID 770507