| SpectraBase Spectrum ID |
55QY6Ya5WEm |
| Name |
17-.alpha.-Hexyl-3-methoxy-estra-1,3,5(10),8(14)-tetraen-17.beta.-ol |
| Alternate Name(s) |
(17beta)-17-hexyl-3-methoxyestra-1,3,5(10),8(14)-tetraen-17-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H36O2 |
| InChI |
InChI=1S/C25H36O2/c1-4-5-6-7-14-25(26)16-13-23-22-10-8-18-17-19(27-3)9-11-20(18)21(22)12-15-24(23,25)2/h9,11,17,21,26H,4-8,10,12-16H2,1-3H3/t21-,24+,25+/m1/s1 |
| InChIKey |
APXVGYYEDHDGJI-ZODMCCGTSA-N |
| Molecular Weight |
368.561 g/mol |
| SMILES |
O[C@@]1([C@@]2(C(=C3[C@](c4ccc(cc4CC3)OC)([H])CC2)CC1)C)CCCCCC |
| SPLASH |
splash10-0gb9-0009000000-cb72f77540fe35f8b109 |
| Source of Spectrum |
QF-42-192-10 |
| Wiley ID |
833010 |
