Dataset

5'-Deoxythymidine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80467 contains the MS mass spectrum of 5'-Deoxythymidine with the InChIkey UGUILUGCFSCUKR-GJMOJQLCSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H14N2O4/c1-5-4-12(10(15)11-9(5)14)8-3-7(13)6(2)16-8/h4,6-8,13H,3H2,1-2H3,(H,11,14,15)/t6-,7+,8-/m1/s1
SMILES C[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C)O
InChI Key UGUILUGCFSCUKR-GJMOJQLCSA-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-BML80467
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:24:25.221833
MetadataModified 2024-01-11T22:24:25.438313
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
DTXSID70188127 EPA CompTox Dashboard
CB0244457 ChemicalBook
ZINC000005765072 ZINC
PD017683 ProbesDrugs
14818996 PubChem: Thomson Pharma
SCHEMBL2056693 SureChEMBL
3458-14-8 ACToR
65120 PubChem
J455.864B Nikkaji
CHEMBL465901 ChEMBL
498242 eMolecules
The data in this table is sourced from UniChem at EBI.