CID 19960485

2-(3-fluorophenyl)-2-methylpropan-1-amine

Structural Information

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

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
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 135.4
[M+Na]+ 190.100238 143.0
[M-H]- 166.103744 137.5
[M+NH4]+ 185.144843 155.8
[M+K]+ 206.074178 140.5
[M+H-H2O]+ 150.108280 129.3
[M+HCOO]- 212.109221 157.4
[M+CH3COO]- 226.124871 182.7
[M+Na-2H]- 188.085686 141.7
[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