Dataset

BENZALDEHYDE BENZYL ETHYL ACETAL; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP009283 contains the MS mass spectrum of BENZALDEHYDE BENZYL ETHYL ACETAL with the InChIkey PNNHDYOYZSRBLH-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C16H18O2/c1-2-17-16(15-11-7-4-8-12-15)18-13-14-9-5-3-6-10-14/h3-12,16H,2,13H2,1H3
SMILES CCOC(OCc(c2)cccc2)c(c1)cccc1
InChI Key PNNHDYOYZSRBLH-UHFFFAOYSA-N
Molecular Formula C16H18O2
Exact Mass 242.131 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-JP009283
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
Related Molecule
  • [ethoxy(phenyl)methoxy]methylbenzene
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DTXSID40773706 EPA CompTox Dashboard
    J354.655A Nikkaji
    71347784 PubChem
    The data in this table is sourced from UniChem at EBI.