| SpectraBase Spectrum ID |
2Ft7ysaKrVK |
| Name |
4-Amino-9-azatricyclo[9.4.0.0(3,8)]pentadeca-1(11),3(8),4,6,12,14-hexaene-2,10-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.074227568 u |
| Formula |
C14H10N2O2 |
| InChI |
InChI=1S/C14H10N2O2/c15-10-6-3-7-11-12(10)13(17)8-4-1-2-5-9(8)14(18)16-11/h1-7H,15H2,(H,16,18) |
| InChIKey |
QTWFCNXAYUDMHJ-UHFFFAOYSA-N |
| Molecular Weight |
238.246 g/mol |
| SMILES |
C1(C2=C(C=CC=C2)C(=O)C2=C(N1)C=CC=C2N)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.974517 |
![4-Amino-9-azatricyclo[9.4.0.0(3,8)]pentadeca-1(11),3(8),4,6,12,14-hexaene-2,10-dione](/api/spectrum/2Ft7ysaKrVK/structure.png?h=300&w=458 "4-Amino-9-azatricyclo[9.4.0.0(3,8)]pentadeca-1(11),3(8),4,6,12,14-hexaene-2,10-dione")
