CID 29594

2-hydroxy-4'-methylbenzophenone

Structural Information

Molecular Formula

C₁₄H₁₂O₂

SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2O

InChI

InChI=1S/C14H12O2/c1-10-6-8-11(9-7-10)14(16)12-4-2-3-5-13(12)15/h2-9,15H,1H3

InChIKey

CEVCYBWRNWZIAA-UHFFFAOYSA-N

Compound name

(2-hydroxyphenyl)-(4-methylphenyl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 54
Patents: 212.08372 Da
Monoisotopic Mass: 3.9
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]+	213.09100	146.4
[M+Na]+	235.07294	161.4
[M+NH4]+	230.11754	155.2
[M+K]+	251.04688	154.1
[M-H]-	211.07644	150.7
[M+Na-2H]-	233.05839	155.8
[M]+	212.08317	149.9
[M]-	212.08427	149.9

Literature stripe

literature stripe

Patent stripe

patents stripe