| SpectraBase Spectrum ID |
EdUNpEB1Kkz |
| Name |
Warfarin-M (HO-) enol 3TMS @ |
| Classification |
Anticoagulant
Rodenticide |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
540.218353988 u |
| Formula |
C28H40O5Si3 |
| InChI |
InChI=1S/C28H40O5Si3/c1-20(31-34(2,3)4)18-24(21-14-12-11-13-15-21)26-27(33-36(8,9)10)23-17-16-22(32-35(5,6)7)19-25(23)30-28(26)29/h11-19,24H,1-10H3/b20-18+ |
| InChIKey |
TUXGPXHANBVZQV-CZIZESTLSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
540.878 g/mol |
| SMILES |
C1(=C(c2ccc(cc2OC1=O)O[Si](C)(C)C)O[Si](C)(C)C)C(\C=C/(O[Si](C)(C)C)C)c1ccccc1 |
| SPLASH |
splash10-0002-2224920000-dca1d38f616b2f033fee |
| 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: UTMS |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Pyranocoumarin-M (O-demethyl-HO-) artifact enol 3TMS |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_4969 |
