| SpectraBase Spectrum ID |
2IfLdbHbyMn |
| Name |
(+-)-warfarin |
| Alternate Name(s) |
3-(.alpha.-acetonylbenzyl)-4-hydroxycoumarin |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H16O4 |
| InChI |
InChI=1S/C19H16O4/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3 |
| InChIKey |
PJVWKTKQMONHTI-UHFFFAOYSA-N |
| Ionization Type |
EI-B |
| Molecular Weight |
308.333 g/mol |
| SMILES |
OC1=C(C(=O)Oc2c1cccc2)C(CC(C)=O)c1ccccc1 |
| SPLASH |
splash10-014i-7692000000-7992c211b8ad4f297468 |
| Source of Spectrum |
SRH-2022-11925-0 |
| Wiley ID |
1833470 |
