SpectraBase Compound ID | GPCwFheQINs |
---|---|
InChI | InChI=1S/C6H2F4N2O2/c7-1-2(8)4(10)6(12(13)14)5(11)3(1)9/h11H2 |
InChIKey | ZXGOZLMDKSUORL-UHFFFAOYSA-N |
Mol Weight | 210.09 g/mol |
Molecular Formula | C6H2F4N2O2 |
Exact Mass | 210.00524 g/mol |
SpectraBase Spectrum ID | A4Nz1pJfgcX |
---|---|
Name | (2,3,4,5-Tetrafluoro-6-nitro-phenyl)amine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 210.005239962 u |
Formula | C6H2F4N2O2 |
InChI | InChI=1S/C6H2F4N2O2/c7-1-2(8)4(10)6(12(13)14)5(11)3(1)9/h11H2 |
InChIKey | ZXGOZLMDKSUORL-UHFFFAOYSA-N |
Molecular Weight | 210.088 g/mol |
SMILES | C=1(F)C(=C(C(=C(C1F)F)F)N)N(=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.954542 |