| SpectraBase Spectrum ID |
KsdeB0AG2DE |
| Name |
3A-Methyl-7-nitro-2-phenyl-9,9A-dihydro-3ah-chromeno[2,3-C]pyrrole-1,3-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.090271554 u |
| Formula |
C18H14N2O5 |
| InChI |
InChI=1S/C18H14N2O5/c1-18-14(10-11-9-13(20(23)24)7-8-15(11)25-18)16(21)19(17(18)22)12-5-3-2-4-6-12/h2-9,14H,10H2,1H3 |
| InChIKey |
YXTYFFVVQHMUJV-UHFFFAOYSA-N |
| Molecular Weight |
338.319 g/mol |
| SMILES |
C1(N(C(C2C1(OC=1C=CC(=CC1C2)N(=O)=O)C)=O)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878611 |
![3a-Methyl-7-nitro-2-phenyl-9,9a-dihydro-3aH-chromeno[2,3-c]pyrrole-1,3-dione](/api/spectrum/KsdeB0AG2DE/structure.png?h=300&w=458 "3a-Methyl-7-nitro-2-phenyl-9,9a-dihydro-3aH-chromeno[2,3-c]pyrrole-1,3-dione")
