| SpectraBase Spectrum ID |
2qfa0Irsjev |
| Name |
4-Methylbenzaldehyde [3-methyl-7-(1-naphthylmethyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
438.180423970 u |
| Formula |
C25H22N6O2 |
| InChI |
InChI=1S/C25H22N6O2/c1-16-10-12-17(13-11-16)14-26-29-24-27-22-21(23(32)28-25(33)30(22)2)31(24)15-19-8-5-7-18-6-3-4-9-20(18)19/h3-14H,15H2,1-2H3,(H,27,29)(H,28,32,33)/b26-14+ |
| InChIKey |
PTAWCHSPZCKRLO-VULFUBBASA-N |
| Molecular Weight |
438.491 g/mol |
| SMILES |
N(C=1N(C2=C(N(C(NC2=O)=O)C)N1)CC=1C=2C(=CC=CC2)C=CC1)\N=C\C1=CC=C(C=C1)C |
![4-methylbenzaldehyde [3-methyl-7-(1-naphthylmethyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone](/api/spectrum/2qfa0Irsjev/structure.png?h=300&w=458 "4-methylbenzaldehyde [3-methyl-7-(1-naphthylmethyl)-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]hydrazone")
