| SpectraBase Spectrum ID |
9zpxCCdbfQC |
| Name |
7-Methoxy-6,8-dinitrocoumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
266.017500534 u |
| Formula |
C10H6N2O7 |
| InChI |
InChI=1S/C10H6N2O7/c1-18-10-6(11(14)15)4-5-2-3-7(13)19-9(5)8(10)12(16)17/h2-4H,1H3 |
| InChIKey |
BNTXGTJNMPILJN-UHFFFAOYSA-N |
| Molecular Weight |
266.165 g/mol |
| SMILES |
C1(=C(C(N(=O)=O)=CC2=C1OC(C=C2)=O)OC)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.878554 |
