Dataset

Naphthalene; GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M]+

This MassBank record with Accession MSBNK-Athens_Univ-AU592020 contains the MS2 mass spectrum of Naphthalene with the InChIkey UFWIBTONFRDIAS-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H8/c1-2-6-10-8-4-3-7-9(10)5-1/h1-8H
SMILES C1=CC2=CC=CC=C2C=C1
InChI Key UFWIBTONFRDIAS-UHFFFAOYSA-N
Molecular Formula C10H8
Exact Mass 128.063 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-Athens_Univ-AU592020
Version
Author
Maintainer
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MetadataPublished 2019-11-21
Related Molecule
  • naphthalene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    CHEBI:16482 chebi
    NPY rcsb_pdb
    CHEMBL16293 chembl
    1272176 surechembl
    1304031 surechembl
    29358073 surechembl
    8953 surechembl
    931 pubchem
    2166IN72UN fdasrs
    PD013825 probes_and_drugs
    NAPHTA CCDC
    120621 brenda
    1830 brenda
    NPY pdbe
    HMDB0029751 hmdb
    50159249 bindingdb
    The data in this table is sourced from UniChem at EBI.