| SpectraBase Spectrum ID |
30gSII41r1n |
| Name |
Benzonitrile, 4-[(8-chloro-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)methyl]- |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H12ClN5O2 |
| InChI |
InChI=1S/C15H12ClN5O2/c1-19-12-11(13(22)20(2)15(19)23)21(14(16)18-12)8-10-5-3-9(7-17)4-6-10/h3-6H,8H2,1-2H3 |
| InChIKey |
VZSSXMLXFLYGEB-UHFFFAOYSA-N |
| Molecular Weight |
329.747 g/mol |
| SMILES |
C(c1ccc(C[n]2c(nc3N(C(N(C)C(=O)c23)=O)C)Cl)cc1)#N |
| SPLASH |
splash10-014i-3902000000-b5483deea4f103917680 |
| Source of Spectrum |
IY-2-4790-9 |
| Synonyms |
4-[(8-chloro-1,3-dimethyl-2,6-dioxo-7-purinyl)methyl]benzonitrile
4-[(8-chloro-1,3-dimethyl-2,6-dioxopurin-7-yl)methyl]benzonitrile
4-[(8-chloro-1,3-dimethyl-2,6-dioxo-purin-7-yl)methyl]benzonitrile
4-[[8-chloranyl-1,3-dimethyl-2,6-bis(oxidanylidene)purin-7-yl]methyl]benzenecarbonitrile |
| Wiley ID |
1655892 |
![Benzonitrile, 4-[(8-chloro-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)methyl]-](/api/spectrum/30gSII41r1n/structure.png?h=300&w=458 "Benzonitrile, 4-[(8-chloro-1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purin-7-yl)methyl]-")
