Dataset

3,3,5-TRIMETHYLCYCLOHEXYL ETHYL ETHER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007215 contains the MS mass spectrum of 3,3,5-TRIMETHYLCYCLOHEXYL ETHYL ETHER with the InChIkey JVBNHJDWWBSWLE-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C11H22O/c1-5-12-10-6-9(2)7-11(3,4)8-10/h9-10H,5-8H2,1-4H3
SMILES CCOC(C1)CC(C)(C)CC(C)1
InChI Key JVBNHJDWWBSWLE-UHFFFAOYSA-N
Molecular Formula C11H22O
Exact Mass 170.167 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-JP007215
Version
Author
Maintainer
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MetadataPublished 2016-01-19
Related Molecule
  • 3-ethoxy-1,1,5-trimethylcyclohexane
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL873371 SureChEMBL
    67583-77-1 ACToR
    DTXSID9051909 EPA CompTox Dashboard
    J182.741C Nikkaji
    106714 PubChem
    The data in this table is sourced from UniChem at EBI.