CID 22482376

1-[2-(2,4-difluorophenyl)phenyl]ethan-1-amine

Structural Information

Molecular Formula
C14H13F2N
SMILES
CC(C1=CC=CC=C1C2=C(C=C(C=C2)F)F)N
InChI
InChI=1S/C14H13F2N/c1-9(17)11-4-2-3-5-12(11)13-7-6-10(15)8-14(13)16/h2-9H,17H2,1H3
InChIKey
AEBRNFBTJDRRBX-UHFFFAOYSA-N
Compound name
1-[2-(2,4-difluorophenyl)phenyl]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

233.10161 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.10889 153.0
[M+Na]+ 256.09083 165.7
[M+NH4]+ 251.13543 160.9
[M+K]+ 272.06477 158.2
[M-H]- 232.09433 155.7
[M+Na-2H]- 254.07628 160.9
[M]+ 233.10106 155.5
[M]- 233.10216 155.5
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