CID 24688686

1-(4-fluorophenyl)-2,2-dimethylpropan-1-amine

Structural Information

Molecular Formula
C11H16FN
SMILES
CC(C)(C)C(C1=CC=C(C=C1)F)N
InChI
InChI=1S/C11H16FN/c1-11(2,3)10(13)8-4-6-9(12)7-5-8/h4-7,10H,13H2,1-3H3
InChIKey
ZUCBPXHMAQFYAI-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-2,2-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

181.12668 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 182.133956 140.3
[M+Na]+ 204.115898 147.3
[M-H]- 180.119404 142.4
[M+NH4]+ 199.160503 160.2
[M+K]+ 220.089838 145.0
[M+H-H2O]+ 164.123940 134.1
[M+HCOO]- 226.124881 161.0
[M+CH3COO]- 240.140531 185.9
[M+Na-2H]- 202.101346 144.8
[M]+ 181.12613142 137.2
[M]- 181.12722858 137.2
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