CID 4032

Mecamylamine

Structural Information

Molecular Formula

C₁₁H₂₁N

SMILES

CC1(C2CCC(C2)C1(C)NC)C

InChI

InChI=1S/C11H21N/c1-10(2)8-5-6-9(7-8)11(10,3)12-4/h8-9,12H,5-7H2,1-4H3

InChIKey

IMYZQPCYWPFTAG-UHFFFAOYSA-N

Compound name

N,2,3,3-tetramethylbicyclo[2.2.1]heptan-2-amine

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 2077
References: 12605
Patents: 167.1674 Da
Monoisotopic Mass: 2.6
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]+	168.174676	138.7
[M+Na]+	190.156618	146.9
[M-H]-	166.160124	142.0
[M+NH4]+	185.201223	168.6
[M+K]+	206.130558	144.3
[M+H-H2O]+	150.164660	135.7
[M+HCOO]-	212.165601	160.3
[M+CH3COO]-	226.181251	184.0
[M+Na-2H]-	188.142066	143.6
[M]+	167.16685142	137.8
[M]-	167.16794858	137.8

Literature stripe

literature stripe

Patent stripe

patents stripe