Dataset

1-BROMONAPHTHALENE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP004649 contains the MS mass spectrum of 1-BROMONAPHTHALENE with the InChIkey DLKQHBOKULLWDQ-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H7Br/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-7H
SMILES c(c2)cc(c1)c(c2)c(Br)cc1
InChI Key DLKQHBOKULLWDQ-UHFFFAOYSA-N
Molecular Formula C10H7Br
Exact Mass 205.973 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP004649
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • 1-bromonaphthalene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    MCULE-2189465084 Mcule
    10016004 NMRShiftDB
    J32.579A Nikkaji
    ZINC000001693600 ZINC
    DECPUZ CCDC
    DTXSID30861681 EPA CompTox Dashboard
    CB5197277 ChemicalBook
    7001 PubChem
    90-11-9 ACToR
    475359 eMolecules
    976Y53P08P FDA SRS
    14773214 PubChem: Thomson Pharma
    27497-51-4 ACToR
    SCHEMBL69629 SureChEMBL
    The data in this table is sourced from UniChem at EBI.