SpectraBase Spectrum ID |
2VyDxltpwen |
Name |
(R)-(-)-Monomethyl 2-methyl-2-(3-methyl-2-nitrophenoxy)malonate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H13NO7 |
InChI |
InChI=1S/C12H13NO7/c1-7-5-4-6-8(9(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 |
XCURKAKFCLXFCW-GFCCVEGCSA-N |
Molecular Weight |
283.236 g/mol |
SMILES |
OC([C@@](Oc1c(N(=O)=O)c(C)ccc1)(C(=O)OC)C)=O |
SPLASH |
splash10-0002-0900000000-c3fd8b810c8b5a67332a |
Source of Spectrum |
QC-10-157-3 |
Synonyms |
(2R)-3-methoxy-2-methyl-2-(3-methyl-2-nitrophenoxy)-3-oxopropanoic acid |
Wiley ID |
871055 |