SpectraBase Spectrum ID |
7B0U5z1W4DA |
Name |
Chlormadinone AC |
CAS Registry Number |
302-22-7 |
Classification |
Gestagen |
Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
404.175437110 u |
Formula |
C23H29ClO4 |
InChI |
InChI=1S/C23H29ClO4/c1-13(25)23(28-14(2)26)10-7-18-16-12-20(24)19-11-15(27)5-8-21(19,3)17(16)6-9-22(18,23)4/h11-12,16-18H,5-10H2,1-4H3 |
InChIKey |
QMBJSIBWORFWQT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
404.934 g/mol |
SMILES |
C=1C(=O)CCC2(C)C3CCC4(C)C(C(C)=O)(CCC4C3C=C(Cl)C12)OC(=O)C |
SPLASH |
splash10-0udi-1339000000-974418d534928473c179 |
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_2477 |