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

*Links on SpectraBase are not permalinks.

Dimethyl 5-acetamido-4-aminoisophthalate

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

Dimethyl 5-acetamido-4-aminoisophthalate
SpectraBase Compound ID 6ZJUptMkG05
InChI InChI=1S/C12H14N2O5/c1-6(15)14-9-5-7(11(16)18-2)4-8(10(9)13)12(17)19-3/h4-5H,13H2,1-3H3,(H,14,15)
InChIKey MTTMXKBBAZHFJL-UHFFFAOYSA-N
Mol Weight 266.25 g/mol
Molecular Formula C12H14N2O5
Exact Mass 266.090272 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

Subscribe to view the full spectrum.

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

SpectraBase Spectrum ID GyRwU65ao9q
Name Dimethyl 5-acetamido-4-aminoisophthalate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 266.090271554 u
Formula C12H14N2O5
InChI InChI=1S/C12H14N2O5/c1-6(15)14-9-5-7(11(16)18-2)4-8(10(9)13)12(17)19-3/h4-5H,13H2,1-3H3,(H,14,15)
InChIKey MTTMXKBBAZHFJL-UHFFFAOYSA-N
SMILES COC(=O)C1=CC(NC(C)=O)=C(N)C(=C1)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.969139