Biological Magnetic Resonance Data Bank

A Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules
Member of WWPDB

1-hydroxy-2-naphthoic Acid

Graphical representations:


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Molecular Formula: C11H8O3

Natural Isotopic Abundance Mass: 188.17942

Mono-Isotopic Molecular Masses:

  • C12N14: 188.0473441231
  • C13N14: 199.0842473389
  • C12N15: 188.0473441231
  • C13N15: 199.0842473389

InChI string: InChI=1S/C11H8O3/c12-10-8-4-2-1-3-7(8)5-6-9(10)11(13)14/h1-6,12H,(H,13,14)

PubChem Compound (CID): 6844
CAS Registry number: 86-48-6
Sigma-Aldrich: 109630_ALDRICH
KEGG Compound ID: C03203
NMRShiftDB: 20096906
NIAID: 018042
ChemDB: 4088390
NIST: 863063989
MMCD: cq_01930
MDL: MFCD00003960

Reference data were obtained primarily from the PubChem database.

Three dimensional molecular rendering uses Jmol.

InChI string and atom numbering calculated using ALATIS (Hesam Dashti, William M. Westler, John L. Markley, Hamid R. Eghbalnia, "Unique identifiers for small molecules enable rigorous labeling of their atoms", Scientific Data 4, Article number: 170073 (2017), doi:10.1038/sdata.2017.73,