| SpectraBase Spectrum ID |
JI3AWTvFwAq |
| Name |
Phenindione |
| CAS Registry Number |
83-12-5 |
| Classification |
Pharmaceutical drug, anticoagulant |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.068079560 u |
| Formula |
C15H10O2 |
| InChI |
InChI=1S/C15H10O2/c16-14-11-8-4-5-9-12(11)15(17)13(14)10-6-2-1-3-7-10/h1-9,13H |
| InChIKey |
NFBAXHOPROOJAW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.243 g/mol |
| Nominal Mass |
222 u |
| Quality |
935 |
| Retention Index |
2055 |
| SMILES |
C1(C(C=2C(C1=O)=CC=CC2)=O)C=1C=CC=CC1 |
| SPLASH |
splash10-00xr-5960000000-8d6e78f127f590851c16 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Fenindion
Phenylindandion
2-Phenylindene-1,3-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011833 |
