Dataset

6-Hydroxyflavanone

This MassBank record with Accession MSBNK-BS-BS003576 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-BS003576
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T12:34:29.017208
MetadataModified 2024-01-11T12:34:29.209302
MetadataPublished 2017-12-01
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
2734580 PubChem
16095762 PubChem: Thomson Pharma
4250-77-5 ACToR
J285.121K Nikkaji
20209224 NMRShiftDB
SCHEMBL126598 SureChEMBL
MCULE-2424476488 Mcule
CB1709715 ChemicalBook
MTBLC34471 Metabolights
136192 Brenda
50296861 BindingDB
1F174812MP FDA SRS
DTXSID1022429 EPA CompTox Dashboard
C14221 KEGG Ligand
CHEMBL195033 ChEMBL
34471 ChEBI
506592 eMolecules
The data in this table is sourced from UniChem at EBI.