| SpectraBase Spectrum ID |
BRiMK9hQ2 |
| Name |
Coumatetralyl-M (tri-HO-) -H2O 2ET |
| Classification |
Anticoagulant
Rodenticide |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
378.146723803 u |
| Formula |
C23H22O5 |
| InChI |
InChI=1S/C23H22O5/c1-3-26-15-10-12-19-17(13-15)22(27-4-2)21(23(25)28-19)20-16-8-6-5-7-14(16)9-11-18(20)24/h5-13,18,20,24H,3-4H2,1-2H3 |
| InChIKey |
IDKYYXXLYZCYRW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
378.424 g/mol |
| SMILES |
C1(=C(c2cc(OCC)ccc2OC1=O)OCC)C1c2c(C=CC1O)cccc2 |
| SPLASH |
splash10-0ar0-2943000000-25d0fe8d9ea217315536 |
| 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_4808 |
