| SpectraBase Spectrum ID |
DkbH1gTWZ8q |
| Name |
Diethylstilbestrol 2AC I |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
352.167459249 u |
| Formula |
C22H24O4 |
| InChI |
InChI=1S/C22H24O4/c1-5-21(17-7-11-19(12-8-17)25-15(3)23)22(6-2)18-9-13-20(14-10-18)26-16(4)24/h7-14H,5-6H2,1-4H3/b22-21+ |
| InChIKey |
NFCAKXYIMSRNLP-QURGRASLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
352.430 g/mol |
| Nominal Mass |
352 u |
| Quality |
908 |
| Retention Index |
2586 |
| SMILES |
C1(\C(=C\(C2=CC=C(OC(=O)C)C=C2)CC)CC)=CC=C(OC(=O)C)C=C1 |
| SPLASH |
splash10-0i00-0986000000-d8565d6eb232be35c74a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-(4-(4-(acetyloxy)phenyl)hex-3-en-3-yl)phenyl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007807 |
