CID 60797712

(3-fluorophenyl)(3-methylphenyl)methanone

Structural Information

Molecular Formula

C₁₄H₁₁FO

SMILES

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

InChI

InChI=1S/C14H11FO/c1-10-4-2-5-11(8-10)14(16)12-6-3-7-13(15)9-12/h2-9H,1H3

InChIKey

OISLLIDIRPFPTG-UHFFFAOYSA-N

Compound name

(3-fluorophenyl)-(3-methylphenyl)methanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 214.07939 Da
Monoisotopic Mass: 3.7
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]+	215.08667	144.1
[M+Na]+	237.06861	152.7
[M-H]-	213.07211	150.0
[M+NH4]+	232.11321	162.7
[M+K]+	253.04255	148.8
[M+H-H2O]+	197.07665	136.4
[M+HCOO]-	259.07759	166.9
[M+CH3COO]-	273.09324	189.0
[M+Na-2H]-	235.05406	149.0
[M]+	214.07884	143.0
[M]-	214.07994	143.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe