CID 169974

2,4-difluorobiphenyl

Structural Information

Molecular Formula
C12H8F2
SMILES
C1=CC=C(C=C1)C2=C(C=C(C=C2)F)F
InChI
InChI=1S/C12H8F2/c13-10-6-7-11(12(14)8-10)9-4-2-1-3-5-9/h1-8H
InChIKey
JVHAJKHGPDDEEU-UHFFFAOYSA-N
Compound name
2,4-difluoro-1-phenylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

373
Patents

190.0594 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.06668 135.2
[M+Na]+ 213.04862 144.9
[M-H]- 189.05212 139.9
[M+NH4]+ 208.09322 155.0
[M+K]+ 229.02256 140.5
[M+H-H2O]+ 173.05666 127.0
[M+HCOO]- 235.05760 158.2
[M+CH3COO]- 249.07325 183.8
[M+Na-2H]- 211.03407 141.9
[M]+ 190.05885 132.2
[M]- 190.05995 132.2
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