| SpectraBase Spectrum ID |
CEpUY3cuwUw |
| Name |
Methyl 5-hydroxy-4-nitro-5-(4-nitrophenyl)pentanoate |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H14N2O7 |
| InChI |
InChI=1S/C12H14N2O7/c1-21-11(15)7-6-10(14(19)20)12(16)8-2-4-9(5-3-8)13(17)18/h2-5,10,12,16H,6-7H2,1H3/t10-,12-/m0/s1 |
| InChIKey |
FNXOZOWIYYWKJQ-JQWIXIFHSA-N |
| Literature Reference DOI |
10.1021/ol1010888 |
| Molecular Weight |
298.251 g/mol |
| SMILES |
O[C@@](c1ccc(cc1)[N+](=O)[O-])([C@@]([N+](=O)[O-])(CCC(OC)=O)[H])[H] |
| SPLASH |
splash10-0umi-6950000000-5686f3013f2bc0ddfa0a |
| Source of Spectrum |
A1-12-3058/SMS6-3g_antiisomer |
| Synonyms |
(4S,5S)-methyl 5-hydroxy-4-nitro-5-(4-nitrophenyl)pentanoate |
| Wiley ID |
1752330 |
