| SpectraBase Compound ID | L0ripxwjw1e |
|---|---|
| InChI | InChI=1S/C23H27F3O3/c1-4-22(29-20(27)23(24,25)26)12-10-19-18-7-5-14-13-15(28-3)6-8-16(14)17(18)9-11-21(19,22)2/h4,6,8,13,17-19H,1,5,7,9-12H2,2-3H3 |
| InChIKey | IZJSUCUMPMZILK-UHFFFAOYSA-N |
| Mol Weight | 408.46 g/mol |
| Molecular Formula | C23H27F3O3 |
| Exact Mass | 408.191229 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | L3t6B6wN7rt |
|---|---|
| Name | 19-Norpregna-1,3,5(10),20-tetraen-17-ol, 3-methoxy-, trifluoroacetate |
| CAS Registry Number | 56588-07-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C23H27F3O3 |
| InChI | InChI=1S/C23H27F3O3/c1-4-22(29-20(27)23(24,25)26)12-10-19-18-7-5-14-13-15(28-3)6-8-16(14)17(18)9-11-21(19,22)2/h4,6,8,13,17-19H,1,5,7,9-12H2,2-3H3 |
| InChIKey | IZJSUCUMPMZILK-UHFFFAOYSA-N |
| Molecular Weight | 408.461 g/mol |
| SMILES | CC12CCC3c4ccc(cc4CCC3C2CCC1(C=C)OC(C(F)(F)F)=O)OC |
| SPLASH | splash10-00n3-6940000000-a86d4260938f1c228b67 |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | 3-Methoxy-17-vinylestra-1,3,5(10)-trien-17-yl trifluoroacetate (17-ethenyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) 2,2,2-trifluoroacetate (17-ethenyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) 2,2,2-tris(fluoranyl)ethanoate (3-methoxy-13-methyl-17-vinyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) 2,2,2-trifluoroacetate 2,2,2-trifluoroacetic acid (17-ethenyl-3-methoxy-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) ester 2,2,2-trifluoroacetic acid (3-methoxy-13-methyl-17-vinyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-17-yl) ester |
| Wiley ID | 1372977 |