| SpectraBase Spectrum ID |
21YX0zmBoe |
| Name |
Carprofen-M (HO-) isomer-2 2ME |
| Classification |
Analgesic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
317.081871076 u |
| Formula |
C17H16ClNO3 |
| InChI |
InChI=1S/C17H16ClNO3/c1-9(17(21)22-3)10-4-5-11-12-7-13(18)16(20)8-15(12)19(2)14(11)6-10/h4-9,20H,1-3H3 |
| InChIKey |
HWRHNDWSHJIYGW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
317.772 g/mol |
| SMILES |
c12cc(Cl)c(cc2[n](C)c2c1ccc(c2)C(C)C(OC)=O)O |
| SPLASH |
splash10-066r-6492000000-c3f0ec44130852294a02 |
| 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. |
| Sample Preparation Procedure |
Detected: UME |
| 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_6287 |
