| SpectraBase Spectrum ID |
JpC7M9fGPSy |
| Name |
(17.beta.)-Estra-1,3,5(10)-triene-3,17-diol decanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H42O3 |
| InChI |
InChI=1S/C28H42O3/c1-3-4-5-6-7-8-9-10-27(30)31-26-16-15-25-24-13-11-20-19-21(29)12-14-22(20)23(24)17-18-28(25,26)2/h12,14,19,23-26,29H,3-11,13,15-18H2,1-2H3/t23-,24-,25+,26+,28+/m1/s1 |
| InChIKey |
YYFQNZXJGOTFRX-VMBLQBCYSA-N |
| Instrument Name |
TRIO-2 VG Masslab Shimadzu QP-5000 and Finnigan TSQ70 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0006.c12 |
| Molecular Weight |
426.641 g/mol |
| Reported Formula |
C28H42O3 |
| SMILES |
Oc1cc2c(cc1)[C@@]1([C@@](CC2)([C@]2([C@](CC1)([C@](CC2)(OC(=O)CCCCCCCCC)[H])C)[H])[H])[H] |
| SPLASH |
splash10-05dl-9810500000-49f3792f414e4f5b5caf |
| Source of Spectrum |
ARK-2005-184-3c |
| Wiley ID |
1870909 |
