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Diethyl-5-aminoisophthalate
SpectraBase Compound ID GJoMDV9wVe4
InChI InChI=1S/C12H15NO4/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7H,3-4,13H2,1-2H3
InChIKey VQRVPAXIXNQFHI-UHFFFAOYSA-N
Mol Weight 237.25 g/mol
Molecular Formula C12H15NO4
Exact Mass 237.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B12UEXx9JnE
Name Diethyl-5-aminoisophthalate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15NO4
InChI InChI=1S/C12H15NO4/c1-3-16-11(14)8-5-9(7-10(13)6-8)12(15)17-4-2/h5-7H,3-4,13H2,1-2H3
InChIKey VQRVPAXIXNQFHI-UHFFFAOYSA-N
Molecular Weight 237.255 g/mol
SMILES Nc1cc(cc(C(=O)OCC)c1)C(=O)OCC
SPLASH splash10-000i-0690000000-6c22f5512804b7bfdf1c
Source of Spectrum JX-2015-6-11875
Synonyms Diethyl 5-aminoisophthalate Diethyl 5-aminobenzene-1,3-dicarboxylate Diethyl 5-azanylbenzene-1,3-dicarboxylate
Wiley ID 1731099