| SpectraBase Compound ID | 7RIPQQUXrC0 |
|---|---|
| InChI | InChI=1S/C24H26O2Se/c1-24-14-13-17-16-9-11-21(26-27)23(15-5-3-2-4-6-15)19(16)8-7-18(17)20(24)10-12-22(24)25/h2-6,9,11,17-18,20,27H,7-8,10,12-14H2,1H3/t17-,18-,20+,24+/m1/s1 |
| InChIKey | KRGWMJMSUJJLAH-OMANQYLTSA-N |
| Mol Weight | 425.44 g/mol |
| Molecular Formula | C24H26O2Se |
| Exact Mass | 426.109802 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | CgRnffhY97U |
|---|---|
| Name | 4-Phenylselenenylestrone |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H26O2Se |
| InChI | InChI=1S/C24H26O2Se/c1-24-14-13-17-16-9-11-21(26-27)23(15-5-3-2-4-6-15)19(16)8-7-18(17)20(24)10-12-22(24)25/h2-6,9,11,17-18,20,27H,7-8,10,12-14H2,1H3/t17-,18-,20+,24+/m1/s1 |
| InChIKey | KRGWMJMSUJJLAH-OMANQYLTSA-N |
| Molecular Weight | 425.442 g/mol |
| SMILES | [SeH]Oc1c(c2c([C@]3(CC[C@]4([C@]([C@@]3(CC2)[H])(CCC4=O)[H])C)[H])cc1)-c1ccccc1 |
| SPLASH | splash10-00b9-0000900000-36f48150763b91a9e93d |
| Source of Spectrum | KC-1991-270-0 |
| Synonyms | 4-Phenyl-3-(selanyloxy)estra-1,3,5(10)-trien-17-one |
| Wiley ID | 1379947 |