| SpectraBase Compound ID | 74ZdDhYlUDW |
|---|---|
| InChI | InChI=1S/C26H30F5NO/c1-25-9-3-4-18(25)16-6-5-14-12-15(7-11-26(14,2)19(16)8-10-25)32-33-13-17-20(27)22(29)24(31)23(30)21(17)28/h3,9,14,16,18-19H,4-8,10-13H2,1-2H3/b32-15+/t14-,16+,18+,19+,25+,26+/m1/s1 |
| InChIKey | UTHTXMHOMPCEAU-XEUNJMOWSA-N |
| Mol Weight | 467.52 g/mol |
| Molecular Formula | C26H30F5NO |
| Exact Mass | 467.224755 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8eCtyGyPIT1 |
|---|---|
| Name | 5.beta.-androst-16-en-3-one-pentafluorobenzyloxime |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H30F5NO |
| InChI | InChI=1S/C26H30F5NO/c1-25-9-3-4-18(25)16-6-5-14-12-15(7-11-26(14,2)19(16)8-10-25)32-33-13-17-20(27)22(29)24(31)23(30)21(17)28/h3,9,14,16,18-19H,4-8,10-13H2,1-2H3/b32-15+/t14-,16+,18+,19+,25+,26+/m1/s1 |
| InChIKey | UTHTXMHOMPCEAU-XEUNJMOWSA-N |
| Molecular Weight | 467.524 g/mol |
| SMILES | c1(c(c(F)c(c(c1F)F)F)F)CO\N=C\1C[C@@]2([C@]([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CC=C4)[H])C)[H])(C)CC1)[H] |
| SPLASH | splash10-0fk9-0090500000-0b85a29370029584e422 |
| Source of Spectrum | KO-21-161-2 |
| Wiley ID | 1392195 |