| SpectraBase Spectrum ID |
20XvkzVml6 |
| Name |
Pyranocoumarin-M (di-HO-) 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 |
410.172938551 u |
| Formula |
C24H26O6 |
| InChI |
InChI=1S/C24H26O6/c1-5-27-16-9-7-15(8-10-16)21-20-22(29-14-24(21,3)26-4)18-13-17(28-6-2)11-12-19(18)30-23(20)25/h7-13,21H,5-6,14H2,1-4H3 |
| InChIKey |
XTPKQIXWMYXZDL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
410.466 g/mol |
| SMILES |
C12=C(c3c(ccc(c3)OCC)OC1=O)OCC(C2c1ccc(cc1)OCC)(OC)C |
| SPLASH |
splash10-03y0-1938400000-005f6009e21a80f1cf58 |
| 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_4838 |
