Dataset

Thymidine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML82261 contains the MS mass spectrum of Thymidine with the InChIkey IQFYYKKMVGJFEH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H14N2O5/c1-5-3-12(10(16)11-9(5)15)8-2-6(14)7(4-13)17-8/h3,6-8,13-14H,2,4H2,1H3,(H,11,15,16)
SMILES CC1=CN(C(=O)NC1=O)C2CC(C(O2)CO)O
InChI Key IQFYYKKMVGJFEH-UHFFFAOYSA-N
Molecular Formula C10H14N2O5
Exact Mass 242.090 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-BML82261
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:26:43.276196
MetadataModified 2024-01-11T22:26:43.442584
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
1134 PubChem
188725 ChEBI
85242739 PubChem: Thomson Pharma
16053-52-4 ACToR
PD011762 ProbesDrugs
SCHEMBL19895 SureChEMBL
J2.569.651D Nikkaji
10016347 NMRShiftDB
MCULE-3606109379 Mcule
HMDB0253921 Human Metabolome Database
THYMDN CCDC
CHEMBL6497 ChEMBL
594813 eMolecules
29549780 eMolecules
The data in this table is sourced from UniChem at EBI.