CID 6485758

3-fluoro-4-(piperidin-1-yl)aniline

Structural Information

Molecular Formula
C11H15FN2
SMILES
C1CCN(CC1)C2=C(C=C(C=C2)N)F
InChI
InChI=1S/C11H15FN2/c12-10-8-9(13)4-5-11(10)14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,13H2
InChIKey
QBVOAZVDLKSGLR-UHFFFAOYSA-N
Compound name
3-fluoro-4-piperidin-1-ylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

217
Patents

194.12193 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.12921 142.5
[M+Na]+ 217.11115 148.4
[M-H]- 193.11465 145.5
[M+NH4]+ 212.15575 159.9
[M+K]+ 233.08509 144.8
[M+H-H2O]+ 177.11919 133.9
[M+HCOO]- 239.12013 161.6
[M+CH3COO]- 253.13578 185.7
[M+Na-2H]- 215.09660 146.5
[M]+ 194.12138 134.7
[M]- 194.12248 134.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe