![3-[3'-(Methoxyethoxy)methoxy]estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol](/api/spectrum/38FJSnTu57t/structure.png?h=300&w=458 "3-[3'-(Methoxyethoxy)methoxy]estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol")
| SpectraBase Compound ID | GHJDa0fnhYF |
|---|---|
| InChI | InChI=1S/C25H38O5/c1-25-11-10-21-20-7-5-19(30-17-28-15-14-27-2)16-18(20)4-6-22(21)23(25)8-9-24(25)29-13-3-12-26/h5,7,16,21-24,26H,3-4,6,8-15,17H2,1-2H3/t21-,22-,23+,24?,25+/m1/s1 |
| InChIKey | XBKBALRKZNCPNV-UDLXLPFGSA-N |
| Mol Weight | 418.6 g/mol |
| Molecular Formula | C25H38O5 |
| Exact Mass | 418.271924 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 38FJSnTu57t |
|---|---|
| Name | 3-[3'-(Methoxyethoxy)methoxy]estra-1',3',5'(10')-trien-17'-yloxy]-1-propanol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C25H38O5 |
| InChI | InChI=1S/C25H38O5/c1-25-11-10-21-20-7-5-19(30-17-28-15-14-27-2)16-18(20)4-6-22(21)23(25)8-9-24(25)29-13-3-12-26/h5,7,16,21-24,26H,3-4,6,8-15,17H2,1-2H3/t21-,22-,23+,24?,25+/m1/s1 |
| InChIKey | XBKBALRKZNCPNV-UDLXLPFGSA-N |
| Molecular Weight | 418.574 g/mol |
| SMILES | OCCCOC1[C@@]2([C@]([C@]3([C@](c4c(cc(OCOCCOC)cc4)CC3)([H])CC2)[H])(CC1)[H])C |
| SPLASH | splash10-052r-9000100000-8a9a78ed79ea941fc8ef |
| Source of Spectrum | U-1995-1628-27 |
| Wiley ID | 767635 |