CID 142433284

2',4'-difluoro-[1,1'-biphenyl]-3,5-diamine

Structural Information

Molecular Formula
C12H10F2N2
SMILES
C1=CC(=C(C=C1F)F)C2=CC(=CC(=C2)N)N
InChI
InChI=1S/C12H10F2N2/c13-8-1-2-11(12(14)5-8)7-3-9(15)6-10(16)4-7/h1-6H,15-16H2
InChIKey
VLDIOICWDGMAJP-UHFFFAOYSA-N
Compound name
5-(2,4-difluorophenyl)benzene-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

220.0812 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.08848 145.2
[M+Na]+ 243.07042 155.1
[M-H]- 219.07392 149.5
[M+NH4]+ 238.11502 163.2
[M+K]+ 259.04436 149.9
[M+H-H2O]+ 203.07846 136.6
[M+HCOO]- 265.07940 169.0
[M+CH3COO]- 279.09505 194.6
[M+Na-2H]- 241.05587 148.9
[M]+ 220.08065 139.7
[M]- 220.08175 139.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe