SpectraBase Compound ID | BvEResyMLMi |
---|---|
InChI | InChI=1S/C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H |
InChIKey | FYFDQJRXFWGIBS-UHFFFAOYSA-N |
Mol Weight | 168.11 g/mol |
Molecular Formula | C6H4N2O4 |
Exact Mass | 168.017107 g/mol |
SpectraBase Spectrum ID | I1PUECioPZb |
---|---|
Name | 1,4-Dinitro benzen |
Comments | MONAID: JP002919 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C6H4N2O4 |
InChI | InChI=1S/C6H4N2O4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H |
InChIKey | FYFDQJRXFWGIBS-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 168.108 g/mol |
SMILES | c1([N+]([O-])=O)ccc(cc1)[N+]([O-])=O |
SPLASH | splash10-00pi-9200000000-849133714d3b632f7b12 |
Source of Spectrum | SRH-2022-2919-0 |
Wiley ID | 1825259 |