Dataset

LINALOOL; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP007560 contains the MS mass spectrum of LINALOOL with the InChIkey CDOSHBSSFJOMGT-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C10H18O/c1-5-10(4,11)8-6-7-9(2)3/h5,7,11H,1,6,8H2,2-4H3
SMILES CC(C)=CCCC(C)(O)C=C
InChI Key CDOSHBSSFJOMGT-UHFFFAOYSA-N
Molecular Formula C10H18O
Exact Mass 154.136 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-JP007560
Version
Author
Maintainer
Language
MetadataPublished 2016-01-19
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    CB5347184 ChemicalBook
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    149157 Brenda
    135998 Brenda
    49180 Brenda
    MTBLC17580 Metabolights
    SCHEMBL20316 SureChEMBL
    10008832 NMRShiftDB
    MCULE-2407576698 Mcule
    J2.830D Nikkaji
    HY-N0368 MedChemExpress
    D81QY6I88E FDA SRS
    DTXSID7025502 EPA CompTox Dashboard
    228758 Brenda
    50459894 BindingDB
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    CHEMBL25306 ChEMBL
    17580 ChEBI
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    C03985 KEGG Ligand
    The data in this table is sourced from UniChem at EBI.