For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Benzene-1,3-dicarboxylic acid, 5-acetylamino-, dimethyl ester
SpectraBase Compound ID 4cN0MwB1ZdM
InChI InChI=1S/C12H13NO5/c1-7(14)13-10-5-8(11(15)17-2)4-9(6-10)12(16)18-3/h4-6H,1-3H3,(H,13,14)
InChIKey ZEQSOHDAWLNLKS-UHFFFAOYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 44Xfxnr6r3e
Name Benzene-1,3-dicarboxylic acid, 5-acetylamino-, dimethyl ester
Alternate Name(s) 3,5-Dicarbomethoxy acetanilide 5-Acetamidobenzene-1,3-dicarboxylic acid dimethyl ester Dimethyl 5-(acetylamino)isophthalate Dimethyl 5-acetamidobenzene-1,3-dicarboxylate Dimethyl 5-acetamidoisophthalate
CAS Registry Number 349407-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c1-7(14)13-10-5-8(11(15)17-2)4-9(6-10)12(16)18-3/h4-6H,1-3H3,(H,13,14)
InChIKey ZEQSOHDAWLNLKS-UHFFFAOYSA-N
Molecular Weight 251.238 g/mol
SMILES N(c1cc(cc(c1)C(=O)OC)C(=O)OC)C(=O)C
SPLASH splash10-0pdi-6890000000-8c59869b2bf38dcad9b3
Wiley ID 1496434