| SpectraBase Spectrum ID |
GDAv5LuE6G |
| Name |
(S)-2-Methylbutyl 3,5-dinitrobenzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14N2O6 |
| InChI |
InChI=1S/C12H14N2O6/c1-3-8(2)7-20-12(15)9-4-10(13(16)17)6-11(5-9)14(18)19/h4-6,8H,3,7H2,1-2H3/t8-/m0/s1 |
| InChIKey |
VNDXIZWVDFDKKJ-QMMMGPOBSA-N |
| Molecular Weight |
282.252 g/mol |
| SMILES |
c1(N(=O)=O)cc(N(=O)=O)cc(c1)C(OC[C@](CC)(C)[H])=O |
| SPLASH |
splash10-002b-4900000000-650b249c9429108f8745 |
| Source of Spectrum |
KC-0-968-4 |
| Synonyms |
3,5-Dinitrobenzoic acid[(2S)-2-methylbutyl]ester
[(2S)-2-methylbutyl]3,5-dinitrobenzoate
[(2S)-2-methylbutyl] 3,5-dinitrobenzoate |
| Wiley ID |
821552 |
