| SpectraBase Spectrum ID |
7yNd72xmLeD |
| Name |
Acemetacin ET |
| Classification |
Antirheumatic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
443.113565126 u |
| Formula |
C23H22ClNO6 |
| InChI |
InChI=1S/C23H22ClNO6/c1-4-30-22(27)13-31-21(26)12-18-14(2)25(20-10-9-17(29-3)11-19(18)20)23(28)15-5-7-16(24)8-6-15/h5-11H,4,12-13H2,1-3H3 |
| InChIKey |
LJPQBEUXEDLQEJ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
443.883 g/mol |
| SMILES |
CCOC(COC(Cc1c([n](c2ccc(OC)cc12)C(c1ccc(cc1)Cl)=O)C)=O)=O |
| SPLASH |
splash10-000l-1901300000-e837f628ca284e69611b |
| 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_3167 |
