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]+ 168.11830 135.4
[M+Na]+ 190.10024 143.0
[M-H]- 166.10374 137.5
[M+NH4]+ 185.14484 155.8
[M+K]+ 206.07418 140.5
[M+H-H2O]+ 150.10828 129.3
[M+HCOO]- 212.10922 157.4
[M+CH3COO]- 226.12487 182.7
[M+Na-2H]- 188.08569 141.7
[M]+ 167.11047 132.7
[M]- 167.11157 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