| SpectraBase Spectrum ID |
50XeOPjyED5 |
| Name |
(R)-Monomethyl 2-methyl-2-(4'-methyl-2'-nitrophenoxy)malonate |
| Alternate Name(s) |
(2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitrophenoxy)-3-oxopropanoic acid
(2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)-3-oxo-propanoic acid
(2R)-3-methoxy-2-methyl-2-(4-methyl-2-nitro-phenoxy)-3-oxidanylidene-propanoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H13NO7 |
| InChI |
InChI=1S/C12H13NO7/c1-7-4-5-9(8(6-7)13(17)18)20-12(2,10(14)15)11(16)19-3/h4-6H,1-3H3,(H,14,15)/t12-/m1/s1 |
| InChIKey |
PFVKUMJPJXHNMP-GFCCVEGCSA-N |
| Molecular Weight |
283.236 g/mol |
| SMILES |
OC([C@@](Oc1c(N(=O)=O)cc(cc1)C)(C(=O)OC)C)=O |
| SPLASH |
splash10-0019-0960000000-a0c15cabf9c3e63cda80 |
| Source of Spectrum |
QC-8-431-3 |
| Wiley ID |
869744 |
