Dataset

Abacavir

This MassBank record with Accession MSBNK-BAFG-CSL2311107844 contains the MS2 mass spectrum of Abacavir with the InChIkey MCGSCOLBFJQGHM-SCZZXKLOSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H18N6O/c15-14-18-12(17-9-2-3-9)11-13(19-14)20(7-16-11)10-4-1-8(5-10)6-21/h1,4,7-10,21H,2-3,5-6H2,(H3,15,17,18,19)/t8-,10+/m1/s1
SMILES Nc1nc(NC2CC2)c3ncn([C@@H]4C[C@H](CO)C=C4)c3n1
InChI Key MCGSCOLBFJQGHM-SCZZXKLOSA-N
Molecular Formula C14H18N6O
Exact Mass 286.154 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311107844
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T10:49:15.250893
MetadataModified 2024-01-11T10:49:15.399956
MetadataPublished 2023-11-10
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables