| SpectraBase Spectrum ID |
ABrmzuJL6oq |
| Name |
Acenocoumarol-M (acetamido-) 2ET |
| Classification |
Anticoagulant |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
421.188922968 u |
| Formula |
C25H27NO5 |
| InChI |
InChI=1S/C25H27NO5/c1-5-26(17(4)28)19-13-11-18(12-14-19)21(15-16(3)27)23-24(30-6-2)20-9-7-8-10-22(20)31-25(23)29/h7-14,21H,5-6,15H2,1-4H3 |
| InChIKey |
ILMDLXBBAROSCN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
421.493 g/mol |
| SMILES |
C1(=C(c2ccccc2OC1=O)OCC)C(c1ccc(N(C(=O)C)CC)cc1)CC(=O)C |
| SPLASH |
splash10-0fb9-1529100000-056a53e04a67c86ba1bf |
| 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: UET |
| 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_4787 |
