![Acetic acid, 2-[7-(acetyloxy)-4b-methyl-2-oxo-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydro-1-phenanthrenyl]-, methyl ester](/api/spectrum/2RnAAm8aRtW/structure.png?h=300&w=458 "Acetic acid, 2-[7-(acetyloxy)-4b-methyl-2-oxo-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydro-1-phenanthrenyl]-, methyl ester")
| SpectraBase Compound ID | Ct74Q8IvK4V |
|---|---|
| InChI | InChI=1S/C20H28O5/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/h13-14,17H,4-11H2,1-3H3 |
| InChIKey | UZXJHBHYUIZLNY-UHFFFAOYSA-N |
| Mol Weight | 348.44 g/mol |
| Molecular Formula | C20H28O5 |
| Exact Mass | 348.193674 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2RnAAm8aRtW |
|---|---|
| Name | Acetic acid, 2-[7-(acetyloxy)-4b-methyl-2-oxo-2,3,4,4a,4b,5,6,7,8,8a,9,10-dodecahydro-1-phenanthrenyl]-, methyl ester |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H28O5 |
| InChI | InChI=1S/C20H28O5/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/h13-14,17H,4-11H2,1-3H3 |
| InChIKey | UZXJHBHYUIZLNY-UHFFFAOYSA-N |
| Molecular Weight | 348.439 g/mol |
| SMILES | C1CC2(C(CC1OC(C)=O)CCC=1C2CCC(=O)C1CC(=O)OC)C |
| SPLASH | splash10-0gdm-5922000000-36227df4d40004b67077 |
| Synonyms | 2-(7-acetoxy-2-keto-4b-methyl-3,4,4a,5,6,7,8,8a,9,10-decahydrophenanthren-1-yl)acetic acid methyl ester 2-(7-acetyloxy-4b-methyl-2-oxo-3,4,4a,5,6,7,8,8a,9,10-decahydrophenanthren-1-yl)acetic acid methyl ester Methyl 2-(7-acetoxy-4b-methyl-2-oxo-3,4,4a,5,6,7,8,8a,9,10-decahydrophenanthren-1-yl)acetate Methyl 2-(7-acetyloxy-4b-methyl-2-oxidanylidene-3,4,4a,5,6,7,8,8a,9,10-decahydrophenanthren-1-yl)ethanoate Methyl 2-(7-acetyloxy-4b-methyl-2-oxo-3,4,4a,5,6,7,8,8a,9,10-decahydrophenanthren-1-yl)acetate |
| Wiley ID | 1477650 |