Dataset

2'-Deoxyadenosine

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80248 contains the MS mass spectrum of 2'-Deoxyadenosine with the InChIkey OLXZPDWKRNYJJZ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(17)6(2-16)18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)
SMILES C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)O
InChI Key OLXZPDWKRNYJJZ-UHFFFAOYSA-N
Molecular Formula C10H13N5O3
Exact Mass 251.102 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-BML80248
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:27:34.247417
MetadataModified 2024-01-11T22:27:34.402601
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
MCULE-1894091442 Mcule
DOXADM CCDC
PD093862 ProbesDrugs
13276-53-4 ACToR
958-09-8 ACToR
3413-66-9 ACToR
60027271 NMRShiftDB
636 PubChem
SCHEMBL12222478 SureChEMBL
50025883 BindingDB
CHEMBL416340 ChEMBL
537473 eMolecules
The data in this table is sourced from UniChem at EBI.