| SpectraBase Compound ID | BiHYhrkoslI |
|---|---|
| InChI | InChI=1S/C21H34O4/c1-13(2)14-7-8-16-19(3)10-6-11-20(4,18(23)25-5)15(19)9-12-21(16,24)17(14)22/h7,13,15-17,22,24H,6,8-12H2,1-5H3 |
| InChIKey | VZUUIOHQORPRQK-UHFFFAOYSA-N |
| Mol Weight | 350.5 g/mol |
| Molecular Formula | C21H34O4 |
| Exact Mass | 350.24571 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6F54jtnFnvT |
|---|---|
| Name | 1-Phenanthrenecarboxylic acid der. |
| CAS Registry Number | 32111-52-7 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H34O4 |
| InChI | InChI=1S/C21H34O4/c1-13(2)14-7-8-16-19(3)10-6-11-20(4,18(23)25-5)15(19)9-12-21(16,24)17(14)22/h7,13,15-17,22,24H,6,8-12H2,1-5H3 |
| InChIKey | VZUUIOHQORPRQK-UHFFFAOYSA-N |
| Molecular Weight | 350.499 g/mol |
| SMILES | OC12C(O)C(=CCC2C2(C)C(CC1)C(C(OC)=O)(C)CCC2)C(C)C |
| SPLASH | splash10-0ir0-0922000000-802b67a1597f4edb9f04 |
| Source of Spectrum | W6-30908-0-0 |
| Synonyms | 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,8,8a,9,10,10a-dodecahydro-8,8a-dihydroxy-1,4a-dimethyl-7-(1-methylethyl)-, methyl ester 8,8a-dihydroxy-1,4a-dimethyl-7-propan-2-yl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester 8,8a-dihydroxy-7-isopropyl-1,4a-dimethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylic acid methyl ester Methyl 1,4a-dimethyl-8,8a-bis(oxidanyl)-7-propan-2-yl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate Methyl 8,8a-dihydroxy-1,4a-dimethyl-7-propan-2-yl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate Methyl 8,8a-dihydroxy-7-isopropyl-1,4a-dimethyl-3,4,4b,5,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate NSC 146188 |
| Wiley ID | 51984 |