| SpectraBase Spectrum ID |
7NQmfsV5Dxl |
| Name |
Fluoranthene, 1,2,4-trinitro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
337.033484951 u |
| Formula |
C16H7N3O6 |
| InChI |
InChI=1S/C16H7N3O6/c20-17(21)12-6-5-10-8-3-1-2-4-9(8)15-14(10)11(12)7-13(18(22)23)16(15)19(24)25/h1-7H |
| InChIKey |
WHKRRYLZSVSUKK-UHFFFAOYSA-N |
| Molecular Weight |
337.247 g/mol |
| SMILES |
C1=CC=C2C(=C1)C=1C=CC(=C3C=C(C(=C2C13)N(=O)=O)N(=O)=O)N(=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.912025 |
