CID 12440702

574008-73-4

Structural Information

Molecular Formula

C₁₂H₁₄F₃N

SMILES

C1CNCCC1C2=CC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C12H14F3N/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16-8-6-10/h1-4,10,16H,5-8H2

InChIKey

AKGAUMQWPLQYHW-UHFFFAOYSA-N

Compound name

4-[4-(trifluoromethyl)phenyl]piperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 269
Patents: 229.10783 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	230.11511	154.9
[M+Na]+	252.09705	164.0
[M+NH4]+	247.14165	161.2
[M+K]+	268.07099	157.7
[M-H]-	228.10055	153.5
[M+Na-2H]-	250.08250	159.9
[M]+	229.10728	155.5
[M]-	229.10838	155.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe