CID 4962877

1-(4-fluorophenyl)-2-methylpropan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H14FN
SMILES
CC(C)C(C1=CC=C(C=C1)F)N
InChI
InChI=1S/C10H14FN/c1-7(2)10(12)8-3-5-9(11)6-4-8/h3-7,10H,12H2,1-2H3
InChIKey
DKHSXWXHXFRKON-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-2-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

173
Patents

167.11102 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.118296 136.3
[M+Na]+ 190.100238 142.9
[M-H]- 166.103744 138.2
[M+NH4]+ 185.144843 156.4
[M+K]+ 206.074178 140.9
[M+H-H2O]+ 150.108280 129.7
[M+HCOO]- 212.109221 157.9
[M+CH3COO]- 226.124871 184.1
[M+Na-2H]- 188.085686 139.4
[M]+ 167.11047142 132.7
[M]- 167.11156858 132.7
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