| SpectraBase Spectrum ID |
BLG60NVUyXM |
| Name |
Pyrimido[4,5-D]pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-6-(phenylmethyl)-1-(3-pyridinylmethyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
349.153874870 u |
| Formula |
C19H19N5O2 |
| InChI |
InChI=1S/C19H19N5O2/c25-18-16-12-23(10-14-5-2-1-3-6-14)13-21-17(16)24(19(26)22-18)11-15-7-4-8-20-9-15/h1-9,21H,10-13H2,(H,22,25,26) |
| InChIKey |
WLZLMGPFXGJESE-UHFFFAOYSA-N |
| Molecular Weight |
349.394 g/mol |
| SMILES |
C1=CC=C(C=C1)CN1CC2=C(N(C(=O)NC2=O)CC2=CC=CN=C2)NC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936485 |
![Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-6-(phenylmethyl)-1-(3-pyridinylmethyl)-](/api/spectrum/BLG60NVUyXM/structure.png?h=300&w=458 "Pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione, 5,6,7,8-tetrahydro-6-(phenylmethyl)-1-(3-pyridinylmethyl)-")
