Dataset

1-Naphthol; LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+

This MassBank record with Accession MSBNK-LCSB-LU113606 contains the MS2 mass spectrum of 1-Naphthol with the InChIkey KJCVRFUGPWSIIH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H8O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7,11H
SMILES OC1=CC=CC2=CC=CC=C12
InChI Key KJCVRFUGPWSIIH-UHFFFAOYSA-N
Molecular Formula C10H8O
Exact Mass 144.058 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-LCSB-LU113606
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MetadataPublished 2020-08-19
Related Molecule
  • naphthalen-1-ol
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:10319 chebi
    1NP rcsb_pdb
    CHEMBL122617 chembl
    29767730 surechembl
    3416 surechembl
    7005 pubchem
    2A71EAQ389 fdasrs
    PD099433 probes_and_drugs
    NAPHOL CCDC
    2542 brenda
    800 brenda
    1NP pdbe
    HMDB0012138 hmdb
    Molport-000-872-002 molport
    23450 bindingdb
    The data in this table is sourced from UniChem at EBI.