CID 604241

4-fluorodiphenylmethane

Structural Information

Molecular Formula

C₁₃H₁₁F

SMILES

C1=CC=C(C=C1)CC2=CC=C(C=C2)F

InChI

InChI=1S/C13H11F/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10H2

InChIKey

ADCBAIUWZPOIMC-UHFFFAOYSA-N

Compound name

1-benzyl-4-fluorobenzene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 273
Patents: 186.08447 Da
Monoisotopic Mass: 4.2
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]+	187.09175	137.3
[M+Na]+	209.07369	145.5
[M-H]-	185.07719	142.8
[M+NH4]+	204.11829	157.0
[M+K]+	225.04763	141.4
[M+H-H2O]+	169.08173	129.7
[M+HCOO]-	231.08267	161.0
[M+CH3COO]-	245.09832	183.0
[M+Na-2H]-	207.05914	144.8
[M]+	186.08392	135.3
[M]-	186.08502	135.3

Literature stripe

literature stripe

Patent stripe

patents stripe