CID 22366497

2-methyl-2-phenylpiperidine

Structural Information

Molecular Formula

C₁₂H₁₇N

SMILES

CC1(CCCCN1)C2=CC=CC=C2

InChI

InChI=1S/C12H17N/c1-12(9-5-6-10-13-12)11-7-3-2-4-8-11/h2-4,7-8,13H,5-6,9-10H2,1H3

InChIKey

FLNODMVWOCAIEF-UHFFFAOYSA-N

Compound name

2-methyl-2-phenylpiperidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 175.1361 Da
Monoisotopic Mass: 2.4
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]+	176.14338	142.0
[M+Na]+	198.12532	155.1
[M+NH4]+	193.16992	153.2
[M+K]+	214.09926	145.1
[M-H]-	174.12882	146.3
[M+Na-2H]-	196.11077	152.0
[M]+	175.13555	145.3
[M]-	175.13665	145.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe