| SpectraBase Spectrum ID |
Kkrk4Vs9NnV |
| Name |
Chlormadinone -H2O |
| Classification |
Gestagen |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
344.154307743 u |
| Formula |
C21H25ClO2 |
| InChI |
InChI=1S/C21H25ClO2/c1-12(23)15-4-5-16-14-11-19(22)18-10-13(24)6-8-21(18,3)17(14)7-9-20(15,16)2/h4,10-11,14,16-17H,5-9H2,1-3H3 |
| InChIKey |
XUOCNUIWQVCVTG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
344.882 g/mol |
| Related CAS Registry Number(s) |
1961-77-9 |
| SMILES |
C=1C(=O)CCC2(C)C3CCC4(C)C(C(C)=O)=CCC4C3C=C(Cl)C12 |
| SPLASH |
splash10-004l-1921000000-7aff5cf7c489330c8d5e |
| 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_2478 |
