| SpectraBase Spectrum ID |
3r4YCgtYVE |
| Name |
Cyclofenil artifact (deacetyl-) |
| Classification |
Antiestrogen |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
322.156894565 u |
| Formula |
C21H22O3 |
| InChI |
InChI=1S/C21H22O3/c1-15(22)24-20-13-9-18(10-14-20)21(16-5-3-2-4-6-16)17-7-11-19(23)12-8-17/h7-14,23H,2-6H2,1H3 |
| InChIKey |
TWMJPMSBYMHQJD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
322.404 g/mol |
| SMILES |
c1c(O)ccc(C(=C2CCCCC2)c2ccc(cc2)OC(C)=O)c1 |
| SPLASH |
splash10-0089-0693000000-3d53a647c4de76b89c20 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_3210 |
