CID 3078709

Brn 3622502

Structural Information

Molecular Formula

C₂₂H₂₀O₃

SMILES

COC1=CC=CC(=C1)C(C2=CC(=CC=C2)OC)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H20O3/c1-24-19-12-6-10-17(14-19)21(18-11-7-13-20(15-18)25-2)22(23)16-8-4-3-5-9-16/h3-15,21H,1-2H3

InChIKey

YRNIFKMEFLYLKP-UHFFFAOYSA-N

Compound name

2,2-bis(3-methoxyphenyl)-1-phenylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 332.14124 Da
Monoisotopic Mass: 4.8
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]+	333.148516	179.7
[M+Na]+	355.130458	185.3
[M-H]-	331.133964	189.0
[M+NH4]+	350.175063	192.5
[M+K]+	371.104398	181.3
[M+H-H2O]+	315.138500	170.0
[M+HCOO]-	377.139441	201.3
[M+CH3COO]-	391.155091	211.2
[M+Na-2H]-	353.115906	182.0
[M]+	332.14069142	181.7
[M]-	332.14178858	181.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe