SpectraBase Spectrum ID |
77CA01yPVnP |
Name |
Indometacin ET @ |
Classification |
Antirheumatic |
Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
385.108085824 u |
Formula |
C21H20ClNO4 |
InChI |
InChI=1S/C21H20ClNO4/c1-4-27-20(24)12-17-13(2)23(19-10-9-16(26-3)11-18(17)19)21(25)14-5-7-15(22)8-6-14/h5-11H,4,12H2,1-3H3 |
InChIKey |
COIRSVPTDJIIKY-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
385.847 g/mol |
SMILES |
CCOC(Cc1c([n](c2ccc(OC)cc12)C(c1ccc(cc1)Cl)=O)C)=O |
SPLASH |
splash10-000i-1904000000-d424f35ae2ebf029a049 |
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 |
Synonyms |
Acemetacin-M/artifact (indometacin) ET
Proglumetacin-M/artifact (indometacin) ET |
Technique |
GC/MS |
Wiley ID |
MMPW6e_3168 |