CID 7514

N-methylcyclohexylamine

Structural Information

Molecular Formula

C₇H₁₅N

SMILES

CNC1CCCCC1

InChI

InChI=1S/C7H15N/c1-8-7-5-3-2-4-6-7/h7-8H,2-6H2,1H3

InChIKey

XTUVJUMINZSXGF-UHFFFAOYSA-N

Compound name

N-methylcyclohexanamine

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 22757
Patents: 113.12045 Da
Monoisotopic Mass: 1.6
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]+	114.12773	124.7
[M+Na]+	136.10967	135.1
[M+NH4]+	131.15427	134.6
[M+K]+	152.08361	128.4
[M-H]-	112.11317	128.0
[M+Na-2H]-	134.09512	131.0
[M]+	113.11990	126.9
[M]-	113.12100	126.9

Literature stripe

literature stripe

Patent stripe

patents stripe