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2,4-Pyridinedicarboxylic acid hydrate

View entire compound with spectra: 3 NMR, 5 FTIR, and 3 Raman

2,4-Pyridinedicarboxylic acid hydrate
SpectraBase Compound ID 9FhnXpJoP3u
InChI InChI=1S/C7H5NO4.H2O/c9-6(10)4-1-2-8-5(3-4)7(11)12;/h1-3H,(H,9,10)(H,11,12);1H2
InChIKey PLNFTNOXJDBMSM-UHFFFAOYSA-N
Mol Weight 185.13 g/mol
Molecular Formula C7H7NO5
Exact Mass 185.032422 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8pU64xnkz2a
Name 2,4-Pyridinedicarboxylic acid monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number P63395
CAS Registry Number 207671-42-9
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5NO5
InChI 1S/C7H5NO4.H2O/c9-6(10)4-1-2-8-5(3-4)7(11)12;/h1-3H,(H,9,10)(H,11,12);1H2
InChIKey PLNFTNOXJDBMSM-UHFFFAOYSA-N
Observed nucleus 1H
Purity 98%
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_1HNMR_012602