SpectraBase Compound ID | EBKwesSpldd |
---|---|
InChI | InChI=1S/C8H6ClNO4/c1-14-8(11)6-4-5(10(12)13)2-3-7(6)9/h2-4H,1H3 |
InChIKey | VCYWZLGOWNCJNJ-UHFFFAOYSA-N |
Mol Weight | 215.59 g/mol |
Molecular Formula | C8H6ClNO4 |
Exact Mass | 214.998535 g/mol |
SpectraBase Spectrum ID | 5r0mRWibCqS |
---|---|
Name | 2-Chloro-5-nitrobenzoic acid methyl ester |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C8H6ClNO4 |
InChI | InChI=1S/C8H6ClNO4/c1-14-8(11)6-4-5(10(12)13)2-3-7(6)9/h2-4H,1H3 |
InChIKey | VCYWZLGOWNCJNJ-UHFFFAOYSA-N |
Ionization Type | EI-B |
Molecular Weight | 215.592 g/mol |
SMILES | COC(=O)c1cc(ccc1Cl)[N+]([O-])=O |
SPLASH | splash10-001i-2910000000-0857bf2b0c19f143dd2b |
Source of Spectrum | SRH-2022-2646-0 |
Wiley ID | 1825001 |