| SpectraBase Spectrum ID |
8wrssYmguMi |
| Name |
2,6-bis(p-Nitrophenoxy)-3-nitrobenzonitrile |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
422.049863290 u |
| Formula |
C19H10N4O8 |
| InChI |
InChI=1S/C19H10N4O8/c20-11-16-18(30-14-5-1-12(2-6-14)21(24)25)10-9-17(23(28)29)19(16)31-15-7-3-13(4-8-15)22(26)27/h1-10H |
| InChIKey |
RNTWPQGETFWGRY-UHFFFAOYSA-N |
| Molecular Weight |
422.309 g/mol |
| SMILES |
N(=O)(=O)C=1C=CC(OC=2C(=C(C=CC2N(=O)=O)OC2=CC=C(C=C2)N(=O)=O)C#N)=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.960502 |
