CID 11194758

3-fluoro-4'-methyl-1,1'-biphenyl

Structural Information

Molecular Formula
C13H11F
SMILES
CC1=CC=C(C=C1)C2=CC(=CC=C2)F
InChI
InChI=1S/C13H11F/c1-10-5-7-11(8-6-10)12-3-2-4-13(14)9-12/h2-9H,1H3
InChIKey
BGVOIDLAUFLERQ-UHFFFAOYSA-N
Compound name
1-fluoro-3-(4-methylphenyl)benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

241
Patents

186.08447 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.09175 136.8
[M+Na]+ 209.07369 145.9
[M-H]- 185.07719 142.8
[M+NH4]+ 204.11829 156.8
[M+K]+ 225.04763 141.9
[M+H-H2O]+ 169.08173 129.4
[M+HCOO]- 231.08267 160.6
[M+CH3COO]- 245.09832 184.1
[M+Na-2H]- 207.05914 143.6
[M]+ 186.08392 135.3
[M]- 186.08502 135.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe