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Perhydrophenanthren-2-one, 7-acetoxy-1-methoxycarbonylmethyl-4b-methyl-
SpectraBase Compound ID Lb7MoUkINnK
InChI InChI=1S/C20H30O5/c1-12(21)25-14-8-9-20(2)13(10-14)4-5-15-16(11-19(23)24-3)18(22)7-6-17(15)20/h13-17H,4-11H2,1-3H3
InChIKey QQEAFFXMHIVZIJ-UHFFFAOYSA-N
Mol Weight 350.46 g/mol
Molecular Formula C20H30O5
Exact Mass 350.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ihb3qMIj8Hf
Name Perhydrophenanthren-2-one, 7-acetoxy-1-methoxycarbonylmethyl-4b-methyl-
Alternate Name(s) 2-(7-acetoxy-2-keto-4b-methyl-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)acetic acid methyl ester 2-(7-acetyloxy-4b-methyl-2-oxo-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)acetic acid methyl ester Methyl 2-(7-acetoxy-4b-methyl-2-oxo-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)acetate Methyl 2-(7-acetyloxy-4b-methyl-2-oxidanylidene-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)ethanoate Methyl 2-(7-acetyloxy-4b-methyl-2-oxo-1,3,4,4a,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl)acetate
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Formula C20H30O5
InChI InChI=1S/C20H30O5/c1-12(21)25-14-8-9-20(2)13(10-14)4-5-15-16(11-19(23)24-3)18(22)7-6-17(15)20/h13-17H,4-11H2,1-3H3
InChIKey QQEAFFXMHIVZIJ-UHFFFAOYSA-N
Molecular Weight 350.455 g/mol
SMILES C12(C(CC(OC(C)=O)CC2)CCC2C1CCC(C2CC(=O)OC)=O)C
SPLASH splash10-004l-8950000000-3134d0b830f42cd51be6
Wiley ID 1477771