CID 62802198

1-(2,4-difluorophenyl)cyclohexan-1-amine

Structural Information

Molecular Formula
C12H15F2N
SMILES
C1CCC(CC1)(C2=C(C=C(C=C2)F)F)N
InChI
InChI=1S/C12H15F2N/c13-9-4-5-10(11(14)8-9)12(15)6-2-1-3-7-12/h4-5,8H,1-3,6-7,15H2
InChIKey
BJEGUZPSPLJRED-UHFFFAOYSA-N
Compound name
1-(2,4-difluorophenyl)cyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

211.11725 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.12453 148.0
[M+Na]+ 234.10647 158.7
[M+NH4]+ 229.15107 157.6
[M+K]+ 250.08041 149.6
[M-H]- 210.10997 150.4
[M+Na-2H]- 232.09192 155.9
[M]+ 211.11670 150.2
[M]- 211.11780 150.2
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