CID 103020

2-phenylpiperidine

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CCNC(C1)C2=CC=CC=C2

InChI

InChI=1S/C11H15N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7,11-12H,4-5,8-9H2

InChIKey

WGIAUTGOUJDVEI-UHFFFAOYSA-N

Compound name

2-phenylpiperidine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 6
References: 1235
Patents: 161.12045 Da
Monoisotopic Mass: 2.2
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]+	162.127726	135.6
[M+Na]+	184.109668	140.0
[M-H]-	160.113174	138.5
[M+NH4]+	179.154273	153.7
[M+K]+	200.083608	136.4
[M+H-H2O]+	144.117710	128.2
[M+HCOO]-	206.118651	153.9
[M+CH3COO]-	220.134301	147.1
[M+Na-2H]-	182.095116	141.9
[M]+	161.11990142	128.0
[M]-	161.12099858	128.0

Literature stripe

literature stripe

Patent stripe

patents stripe