Dataset

6-Hydroxyflavanone

This MassBank record with Accession MSBNK-BS-BS003575 contains the MS2 mass spectrum of 6-Hydroxyflavanone with the InChIkey XYHWPQUEOOBIOW-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C15H12O3/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15-16H,9H2
SMILES C1(C(OC2=C(C1=O)C(=C(C(=C2[H])[H])O[H])[H])(C3=C(C(=C(C(=C3[H])[H])[H])[H])[H])[H])([H])[H]
InChI Key XYHWPQUEOOBIOW-UHFFFAOYSA-N
Molecular Formula C15H12O3
Exact Mass 240.079 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BS-BS003575
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:33:04.431321
MetadataModified 2024-01-11T12:33:04.588572
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C14221 KEGG Ligand
CHEMBL195033 ChEMBL
34471 ChEBI
506592 eMolecules
MTBLC34471 Metabolights
136192 Brenda
CB1709715 ChemicalBook
2734580 PubChem
16095762 PubChem: Thomson Pharma
4250-77-5 ACToR
50296861 BindingDB
DTXSID1022429 EPA CompTox Dashboard
1F174812MP FDA SRS
MCULE-2424476488 Mcule
SCHEMBL126598 SureChEMBL
J285.121K Nikkaji
20209224 NMRShiftDB
MolPort-001-792-222 MolPort
The data in this table is sourced from UniChem at EBI.