| SpectraBase Spectrum ID |
CsL4PeRbiUY |
| Name |
5,12-Diamino-1,4,6,11-tetraoxo-1,2,3,4,6,11-hexahydronaphtho[2,3-G]phthalazine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.070204814 u |
| Formula |
C16H10N4O4 |
| InChI |
InChI=1S/C16H10N4O4/c17-11-7-8(12(18)10-9(11)15(23)19-20-16(10)24)14(22)6-4-2-1-3-5(6)13(7)21/h1-4H,17-18H2,(H,19,23)(H,20,24) |
| InChIKey |
YEHIKKKMCPNONR-UHFFFAOYSA-N |
| Molecular Weight |
322.280 g/mol |
| SMILES |
C12=C(C(N)=C3C(=C2N)C(C2=C(C=CC=C2)C3=O)=O)C(=O)NNC1=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915973 |
![5,12-Diamino-1,4,6,11-tetraoxo-1,2,3,4,6,11-hexahydronaphtho[2,3-g]phthalazine](/api/spectrum/CsL4PeRbiUY/structure.png?h=300&w=458 "5,12-Diamino-1,4,6,11-tetraoxo-1,2,3,4,6,11-hexahydronaphtho[2,3-g]phthalazine")
