Dataset

N4-Anisoyl-2'-deoxycytidine; LC-ESI-QTOF; MS; POSITIVE

This MassBank record with Accession MSBNK-Washington_State_Univ-BML81745 contains the MS mass spectrum of N4-Anisoyl-2'-deoxycytidine with the InChIkey ZASFNFUJGOZQBW-NEJHNUGDSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C17H19N3O6/c1-25-11-4-2-10(3-5-11)16(23)18-14-6-7-20(17(24)19-14)15-8-12(22)13(9-21)26-15/h2-7,12-13,15,21-22H,8-9H2,1H3,(H,18,19,23,24)/t12-,13+,15?/m1/s1
SMILES COC1=CC=C(C=C1)C(=O)NC2=NC(=O)N(C=C2)C3C[C@H]([C@@H](O3)CO)O
InChI Key ZASFNFUJGOZQBW-NEJHNUGDSA-N
Molecular Formula C17H19N3O6
Exact Mass 361.127 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81745
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MetadataPublished 2016-01-19
Related Molecule
  • N-[1-[(4R,5S)-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-2-oxopyrimidin-4-yl]-4-methoxybenzamide
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    3037652 PubChem
    48212-99-3 ACToR
    181847 ChEBI
    The data in this table is sourced from UniChem at EBI.