Dataset

4-Hydroxydebrisoquin

This MassBank record with Accession MSBNK-Waters-WA002890 contains the MS mass spectrum of 4-Hydroxydebrisoquin with the InChIkey AKFURXZANOMQBD-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C10H13N3O/c11-10(12)13-5-7-3-1-2-4-8(7)9(14)6-13/h1-4,9,14H,5-6H2,(H3,11,12)
SMILES NC(=N)N(C1)Cc(c2)c(ccc2)C(O)1
InChI Key AKFURXZANOMQBD-UHFFFAOYSA-N
Molecular Formula C10H13N3O
Exact Mass 191.106 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA002890
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:47:48.126854
MetadataModified 2024-01-11T22:47:48.285511
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1710849 ChEMBL
1935104 eMolecules
SCHEMBL11720799 SureChEMBL
60021066 NMRShiftDB
63800 ChEBI
59333-79-8 ACToR
15042353 PubChem: Thomson Pharma
107669 PubChem
MTBLC63800 Metabolights
J385.174E Nikkaji
HMDB0006468 Human Metabolome Database
The data in this table is sourced from UniChem at EBI.