| SpectraBase Spectrum ID |
Kin7N7xa5wA |
| Name |
Barbituric acid |
| CAS Registry Number |
67-52-7 |
| Collision Energy |
15 eV |
| Copyright |
Copyright © 2012-2025 Herbert Oberacher. All Rights Reserved. |
| Exact Mass |
128.022191994 u |
| Formula |
C4H4N2O3 |
| InChI |
InChI=1S/C4H4N2O3/c7-2-1-3(8)6-4(9)5-2/h1H2,(H2,5,6,7,8,9) |
| InChIKey |
HNYOPLTXPVRDBG-UHFFFAOYSA-N |
| Instrument Name |
QStar XL, AB Sciex |
| Ion Polarity |
N |
| Ionization Type |
ESI- |
| Molecular Weight |
128.087 g/mol |
| Nominal Mass |
128 u |
| Precursor Ion |
[M-H]- |
| Precursor m/z |
127.015 |
| SMILES |
N1C(=O)NC(=O)CC1=O |
| Selected Ion Charge |
-1 |
| Source of Spectrum |
Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria |
| Spectrum Type |
ms2 |
| Synonyms |
1,3-diazinane-2,4,6-trione |
| Technique |
Q-TOF |
| Wiley ID |
MSforID_-_28.2 |
