CID 10845463

4-benzyl-4-fluoropiperidine hydrochloride

Structural Information

Molecular Formula
C12H16FN
SMILES
C1CNCCC1(CC2=CC=CC=C2)F
InChI
InChI=1S/C12H16FN/c13-12(6-8-14-9-7-12)10-11-4-2-1-3-5-11/h1-5,14H,6-10H2
InChIKey
COCCCOQGYHIOAM-UHFFFAOYSA-N
Compound name
4-benzyl-4-fluoropiperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

193.12668 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.133956 143.8
[M+Na]+ 216.115898 148.8
[M-H]- 192.119404 145.5
[M+NH4]+ 211.160503 162.6
[M+K]+ 232.089838 144.8
[M+H-H2O]+ 176.123940 135.6
[M+HCOO]- 238.124881 160.7
[M+CH3COO]- 252.140531 154.7
[M+Na-2H]- 214.101346 149.8
[M]+ 193.12613142 135.6
[M]- 193.12722858 135.6
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