Dataset

3-METHYLPHENYLAMINO-2-METHYL-2-BUTEN-4-OLIDE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008123 contains the MS mass spectrum of 3-METHYLPHENYLAMINO-2-METHYL-2-BUTEN-4-OLIDE with the InChIkey KSQNRBUGSVRPHY-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C12H13NO2/c1-9-11(8-15-12(9)14)13(2)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
SMILES O=C(O2)C(C)=C(C2)N(C)c(c1)cccc1
InChI Key KSQNRBUGSVRPHY-UHFFFAOYSA-N
Molecular Formula C12H13NO2
Exact Mass 203.095 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-JP008123
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MetadataPublished 2016-01-19
Related Molecule
  • 4-methyl-3-(N-methylanilino)-2H-furan-5-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    85585224 PubChem
    J261.119H Nikkaji
    The data in this table is sourced from UniChem at EBI.