CID 10728141

4-[(3-fluorophenyl)methyl]piperidine

Structural Information

Molecular Formula
C12H16FN
SMILES
C1CNCCC1CC2=CC(=CC=C2)F
InChI
InChI=1S/C12H16FN/c13-12-3-1-2-11(9-12)8-10-4-6-14-7-5-10/h1-3,9-10,14H,4-8H2
InChIKey
ZXAPMANOWGBURM-UHFFFAOYSA-N
Compound name
4-[(3-fluorophenyl)methyl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

154
Patents

193.12668 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.133956 143.1
[M+Na]+ 216.115898 148.0
[M-H]- 192.119404 144.6
[M+NH4]+ 211.160503 160.1
[M+K]+ 232.089838 143.7
[M+H-H2O]+ 176.123940 134.6
[M+HCOO]- 238.124881 159.9
[M+CH3COO]- 252.140531 180.9
[M+Na-2H]- 214.101346 147.4
[M]+ 193.12613142 135.0
[M]- 193.12722858 135.0
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