SpectraBase Compound ID | AwBcbqNgu2E |
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InChI | InChI=1S/C21H29ClO2/c1-12(23)14-6-7-15-13-4-5-17-19(22)18(24)9-11-21(17,3)16(13)8-10-20(14,15)2/h13-16H,4-11H2,1-3H3 |
InChIKey | MSWUPHPHYAFBLX-UHFFFAOYSA-N |
Mol Weight | 348.91 g/mol |
Molecular Formula | C21H29ClO2 |
Exact Mass | 348.185608 g/mol |
SpectraBase Spectrum ID | 86vqs2iSQDS |
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Name | Pregn-4-ene-3,20-dione, 4-chloro- |
CAS Registry Number | 1164-81-4 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C21H29ClO2 |
InChI | InChI=1S/C21H29ClO2/c1-12(23)14-6-7-15-13-4-5-17-19(22)18(24)9-11-21(17,3)16(13)8-10-20(14,15)2/h13-16H,4-11H2,1-3H3 |
InChIKey | MSWUPHPHYAFBLX-UHFFFAOYSA-N |
Molecular Weight | 348.914 g/mol |
SMILES | CC12C3C(C4C(C)(C(C(C)=O)CC4)CC3)CCC1=C(Cl)C(=O)CC2 |
SPLASH | splash10-01ox-9713000000-b3e556e19c12de0fea0f |
Source of Spectrum | EP-1341-0-0 |
Synonyms | 17-acetyl-4-chloro-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 4-Chlor-progesterone 4-Chloranyl-17-ethanoyl-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one 4-Chloropregn-4-ene-3,20-dione BRN 3105722 NSC 18308 |
Wiley ID | 1340794 |