Dataset

Acyclovir; LC-ESI-QQ; MS2; CE:50 V; [M+H]+

This MassBank record with Accession MSBNK-Keio_Univ-KO002217 contains the MS2 mass spectrum of Acyclovir with the InChIkey MKUXAQIIEYXACX-UHFFFAOYSA-N.

Chemical Information

molecular Image
InChI InChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)
SMILES OCCOCn(c2)c(N1)c(n2)C(=O)N=C(N)1
InChI Key MKUXAQIIEYXACX-UHFFFAOYSA-N
Molecular Formula C8H11N5O3
Exact Mass 225.086 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-Keio_Univ-KO002217
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MetadataPublished 2016-01-19
Related Molecule
  • 2-amino-9-(2-hydroxyethoxymethyl)-3H-purin-6-one
    • Field Value
    Measurement Technique liquid chromatography-mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.