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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)

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SpectraBase Spectrum ID 4ZvQLrbpeoS
Name Benzene-1,3-dicarboxylic acid, 5-acetylamino-, dimethyl ester
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(C(OC)=O)cc(c1)C(=O)OC)C(C)=O
SPLASH splash10-0zou-8980000000-0ff4e755f9b9511f1fa0
Source of Spectrum JX-2015-1-688
Synonyms 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
Wiley ID 1721480