| SpectraBase Spectrum ID |
6XK8biGpwz1 |
| Name |
4-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2,4-dioxo-5-pyrimidinyl]benzonitrile |
| CAS Registry Number |
92524-53-3 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H15N3O5 |
| InChI |
InChI=1S/C16H15N3O5/c17-6-9-1-3-10(4-2-9)11-7-19(16(23)18-15(11)22)14-5-12(21)13(8-20)24-14/h1-4,7,12-14,20-21H,5,8H2,(H,18,22,23)/t12-,13+,14+/m0/s1 |
| InChIKey |
DHUVNAYILSHSBB-BFHYXJOUSA-N |
| Molecular Weight |
329.312 g/mol |
| SMILES |
N1C(C(=CN([C@]2(C[C@@]([C@](O2)(CO)[H])(O)[H])[H])C1=O)c1ccc(C#N)cc1)=O |
| SPLASH |
splash10-014i-0931000000-8bafecf62c34d98eead0 |
| Source of Spectrum |
J-52-3630-14 |
| Synonyms |
4-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2,4-dioxopyrimidin-5-yl]benzonitrile
4-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-2,4-dioxo-pyrimidin-5-yl]benzonitrile
4-[1-[(2R,4S,5R)-4-hydroxy-5-methylol-tetrahydrofuran-2-yl]-2,4-diketo-pyrimidin-5-yl]benzonitrile
4-[1-[(2R,4S,5R)-5-(hydroxymethyl)-4-oxidanyl-oxolan-2-yl]-2,4-bis(oxidanylidene)pyrimidin-5-yl]benzenecarbonitrile |
| Wiley ID |
1327011 |
![4-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2,4-dioxo-5-pyrimidinyl]benzonitrile](/api/spectrum/6XK8biGpwz1/structure.png?h=300&w=458 "4-[1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)-2-oxolanyl]-2,4-dioxo-5-pyrimidinyl]benzonitrile")
