| SpectraBase Spectrum ID |
Cd3Uaol3rms |
| Name |
(R)-Monoethyl 2-methyl-2-(4'-methyl-2'-nitrophenoxy)malonate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO7 |
| InChI |
InChI=1S/C13H15NO7/c1-4-20-12(17)13(3,11(15)16)21-10-6-5-8(2)7-9(10)14(18)19/h5-7H,4H2,1-3H3,(H,15,16)/t13-/m1/s1 |
| InChIKey |
KZFLWMAHEXJLBK-CYBMUJFWSA-N |
| Molecular Weight |
297.263 g/mol |
| SMILES |
OC([C@@](Oc1c(N(=O)=O)cc(cc1)C)(C(=O)OCC)C)=O |
| SPLASH |
splash10-03di-0920000000-115e90c9400cd4c4f429 |
| Source of Spectrum |
QC-8-431-3 |
| Synonyms |
(2R)-3-ethoxy-2-methyl-2-(4-methyl-2-nitrophenoxy)-3-oxopropanoic acid |
| Wiley ID |
869743 |
