CID 10251

Flavanone

Structural Information

Molecular Formula

C₁₅H₁₂O₂

SMILES

C1C(OC2=CC=CC=C2C1=O)C3=CC=CC=C3

InChI

InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2

InChIKey

ZONYXWQDUYMKFB-UHFFFAOYSA-N

Compound name

2-phenyl-2,3-dihydrochromen-4-one

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 1080
References: 16552
Patents: 224.08372 Da
Monoisotopic Mass: 3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	225.090996	146.8
[M+Na]+	247.072938	154.6
[M-H]-	223.076444	155.0
[M+NH4]+	242.117543	164.5
[M+K]+	263.046878	151.8
[M+H-H2O]+	207.080980	139.4
[M+HCOO]-	269.081921	167.6
[M+CH3COO]-	283.097571	159.9
[M+Na-2H]-	245.058386	154.9
[M]+	224.08317142	145.6
[M]-	224.08426858	145.6

Literature stripe

literature stripe

Patent stripe

patents stripe