| SpectraBase Spectrum ID |
Ecby5Uy9oaX |
| Name |
MONO-DEUTERO-3-METHOXYESTRA-1,3,5(10)-TRIEN-17-YL ACETATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
328.203844759 u |
| Formula |
C21H28O3 |
| InChI |
InChI=1S/C21H28O3/c1-13(22)24-20-9-8-19-18-6-4-14-12-15(23-3)5-7-16(14)17(18)10-11-21(19,20)2/h5,7,12,17-20H,4,6,8-11H2,1-3H3/t17?,18?,19?,20?,21-/m0/s1 |
| InChIKey |
FMNPCVNWRFPDCA-ALAWOQLPSA-N |
| Molecular Weight |
328.452 g/mol |
| Nominal Mass |
328 u |
| Number of Peaks |
291 |
| SMILES |
C(C)(=O)OC1CCC2C3CCc4cc(ccc4C3CC[C@]12C)OC |
| SPLASH |
splash10-00bc-3941000000-6770081290010ec7732a |
| Source File Reference |
LMCM-89540-871L |
| Source of Spectrum |
Prof. J. Seibl; ETH Zurich, Switzerland |
| Synonyms |
mono-deutero-(15S)-5-methoxy-15-methyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-2(7),3,5-trien-14-yl acetate |
| Wiley ID |
8_20014 |
