Dataset

3'-Adenylic acid

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80366 contains the MS mass spectrum of 3'-Adenylic acid with the InChIkey LNQVTSROQXJCDD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H14N5O7P/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(4(1-16)21-10)22-23(18,19)20/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H2,18,19,20)
SMILES C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)OP(=O)(O)O)O
InChI Key LNQVTSROQXJCDD-UHFFFAOYSA-N
Molecular Formula C10H14N5O7P
Exact Mass 347.063 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-BML80366
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:22:16.600050
MetadataModified 2024-01-11T22:22:16.752089
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
PD070004 ProbesDrugs
256105 PubChem
84-21-9 ACToR
HMDB0258140 Human Metabolome Database
SCHEMBL17346493 SureChEMBL
The data in this table is sourced from UniChem at EBI.