Dataset

2',3'-Dideoxythymidine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML01386 contains the MS2 mass spectrum of 2',3'-Dideoxythymidine with the InChIkey XKKCQTLDIPIRQD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H14N2O4/c1-6-4-12(10(15)11-9(6)14)8-3-2-7(5-13)16-8/h4,7-8,13H,2-3,5H2,1H3,(H,11,14,15)
SMILES CC1=CN(C(=O)NC1=O)C2CCC(O2)CO
InChI Key XKKCQTLDIPIRQD-UHFFFAOYSA-N
Molecular Formula C10H14N2O4
Exact Mass 226.095 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-BML01386
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:28:54.024165
MetadataModified 2024-01-11T22:28:54.191722
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL23970 ChEMBL
749330 eMolecules
5280 PubChem
16558289 PubChem: Thomson Pharma
SCHEMBL762579 SureChEMBL
PD150967 ProbesDrugs
HMDB0246094 Human Metabolome Database
8000 Brenda
The data in this table is sourced from UniChem at EBI.