Dataset

2-(N-ACETYL-2-ACETOXYETHYLAMINO)TOLUENE; EI-B; MS

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP006681 contains the MS mass spectrum of 2-(N-ACETYL-2-ACETOXYETHYLAMINO)TOLUENE with the InChIkey ICTRVJDZFDRVOX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C13H17NO3/c1-10-6-4-5-7-13(10)14(11(2)15)8-9-17-12(3)16/h4-7H,8-9H2,1-3H3
SMILES CC(=O)OCCN(C(C)=O)c(c1)c(C)ccc1
InChI Key ICTRVJDZFDRVOX-UHFFFAOYSA-N
Molecular Formula C13H17NO3
Exact Mass 235.121 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-JP006681
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MetadataPublished 2016-01-19
Related Molecule
  • 2-(N-acetyl-2-methylanilino)ethyl acetate
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    12570528 PubChem
    J183.110K Nikkaji
    The data in this table is sourced from UniChem at EBI.