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

21
Patents

193.12668 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.13396 143.8
[M+Na]+ 216.11590 148.8
[M-H]- 192.11940 145.5
[M+NH4]+ 211.16050 162.6
[M+K]+ 232.08984 144.8
[M+H-H2O]+ 176.12394 135.6
[M+HCOO]- 238.12488 160.7
[M+CH3COO]- 252.14053 154.7
[M+Na-2H]- 214.10135 149.8
[M]+ 193.12613 135.6
[M]- 193.12723 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