| SpectraBase Spectrum ID |
EurO9PUyHp3 |
| Name |
ESTRA-1,3,5(10)-TRIENE-2-BROMO-17.ALPHA.-ETHYNYL-3,17.BETA.-DIOL |
| Alternate Name(s) |
2-BROMO-17-ETHYNYLESTRA-1(10),2,4-TRIENE-3,17-DIOL |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C20H23BrO2 |
| InChI |
InChI=1S/C20H23BrO2/c1-3-20(23)9-7-16-14-5-4-12-10-18(22)17(21)11-15(12)13(14)6-8-19(16,20)2/h1,10-11,13-14,16,22-23H,4-9H2,2H3 |
| InChIKey |
GBWFPAZWDFDHNA-UHFFFAOYSA-N |
| Nominal Mass |
374 u |
| Owner |
Database Compilation (C) 2005 Wiley & Sons, Inc. |
| SMILES |
C12(C)CCC3C(CCc4cc(O)c(Br)cc34)C2CCC1(O)C#C |
| SPLASH |
splash10-0006-1294000000-2d078500b7632110e66c |
| Source File Reference |
LMCM-55172-946E |
| Source of Spectrum |
Copyright (C) Dr. Makin, London Hospital Medical College, UK |
