Orotic acid
Compound with spectra: 7 NMR, 3 FTIR, 1 Raman, 1 UV-Vis, and 2 MS (GC)
| SpectraBase Compound ID | KKa1TyfV259 |
|---|---|
| InChI | InChI=1S/C5H4N2O4/c8-3-1-2(4(9)10)6-5(11)7-3/h1H,(H,9,10)(H2,6,7,8,11) |
| InChIKey | PXQPEWDEAKTCGB-UHFFFAOYSA-N |
| Mol Weight | 156.1 g/mol |
| Molecular Formula | C5H4N2O4 |
| Exact Mass | 156.017107 g/mol |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Calbiochem, EMD Chemicals, Inc., an Affiliate of Merck KGaA, Darmstadt, Germany |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 7280 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Technique | KBr-Pellet |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | E. MERCK AG, DARMSTADT, GERMANY |
| Technique | KBr WAFER |
| Copyright | Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO-D6 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|
| Copyright | Database Compilation Copyright © 2021-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Polysol-d |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | DMSO-d6 |
| Copyright | Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Sample | Calbiochem, EMD Chemicals, Inc., an Affiliate of Merck KGaA, Darmstadt, Germany |
| Source of Spectrum | Forensic Spectral Research |
| Catalog Number | 4990 |
| Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Solvent | Methanol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | EP-1639-0-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
|---|---|
| Source of Spectrum | RCM-16-2045-4 |
- 6-Carboxy-2,4-deoxypyrimidine
- Orotate
- ortic acid
- PXQPEWDEAKTCGB-UHFFFAOYSA-N
- 6-URACILCARBOXYLIC ACID
- 4-PYRIMIDINECARBOXYLIC ACID, 2,6- DIHYDROXY-,
- 4-PYRIMIDINECARBOXYLIC ACID, 2,6- DIOXO-1,2,3,6-TETRAHYDRO-,
- 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-
- 1,2,3,6-Tetrahydro-2,6-dioxo-4-pyrimidinecarboxylic acid
- 2-Hydroxy-6-oxo-1H-pyrimidine-4-carboxylic acid
- 2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinecarboxylic acid
- Uracil, 6-carboxy-
6-(formamidomethyl)uracil
6-Butyl-1H-pyrimidine-2,4-dione
2,4(1H,3H)-Pyrimidinedione, 6-(trifluoromethyl)-
N-(2,6-Dioxo-1,2,3,6-tetrahydro-4-pyrimidinyl)acetamide
6-(tert-butyl)-2-thioxo-2,3-dihydropyrimidin-4(1H)-one
HTTGMSYLAYSOLD-ZZXKWVIFSA-N
4(1H)-Pyrimidinone, 2,3-dihydro-2-thioxo-6-(trifluoromethyl)-
5-(Trimethylsilyl)-2,4(1H,3H)-pyrimidinedione
Acetamide, N-(2,5-dihydro-5-methyl-2-oxo-3-furanyl)-
5-tert-Butyl-2,4(1H,3H)-pyrimidinedione
| Title | Journal or Book | Year |
|---|---|---|
| Substituent and solvent effects on tautomeric equilibria of barbituric acid derivatives and isoterically related compounds | Journal of Heterocyclic Chemistry | 1987 |
This compound is available in the following databases:
Wiley Registry of Tandem Mass Spectral Data: MS for ID
Author: Herbert Oberacher, Institute of Legal Medicine, Innsbruck/Austria
The Wiley Registry® of Tandem Mass Spectral Data: MS for ID contains 10,000 positive and negative mode spectra of over 1200 compounds of interest for forensics, toxicology, and pathology. Learn more.
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.