Dataset

DIMETHYLACRYLIC ACID SOBREOL ESTER; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP010137 contains the MS mass spectrum of DIMETHYLACRYLIC ACID SOBREOL ESTER with the InChIkey PYDAVHFDKJZDEH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H24O3/c1-10(2)8-14(16)18-13-9-12(15(4,5)17)7-6-11(13)3/h6,8,12-13,17H,7,9H2,1-5H3
SMILES CC(C)=CC(=O)OC(C(C)=1)CC(CC1)C(C)(C)O
InChI Key PYDAVHFDKJZDEH-UHFFFAOYSA-N
Molecular Formula C15H24O3
Exact Mass 252.173 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-JP010137
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:56:09.524367
MetadataModified 2025-07-14T21:45:13.643133
MetadataPublished 2016-01-19
Related Molecule
  • [5-(2-hydroxypropan-2-yl)-2-methylcyclohex-2-en-1-yl] 3-methylbut-2-enoate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    102064463 PubChem
    J812.657G Nikkaji
    The data in this table is sourced from UniChem at EBI.