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

*Links on SpectraBase are not permalinks.

5-Methylisophthalic acid

View entire compound with spectra: 3 NMR, 2 FTIR, 1 Raman, and 1 MS (GC)

5-Methylisophthalic acid
SpectraBase Compound ID 9cCnMTz5kY0
InChI InChI=1S/C9H8O4/c1-5-2-6(8(10)11)4-7(3-5)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)
InChIKey PMZBHPUNQNKBOA-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID G1LClEIOFdA
Name 5-METHYLISOPHTHALIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8O4
InChI InChI=1S/C9H8O4/c1-5-2-6(8(10)11)4-7(3-5)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)
InChIKey PMZBHPUNQNKBOA-UHFFFAOYSA-N
Melting Point 292-295C
Molecular Weight 180.16
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms UVITIC ACID ISOPHTHALIC ACID, 5-METHYL-,