CID 200463

N,n-diethyl-3-cyclohexene-1-methylamine hydrochloride

Structural Information

Molecular Formula
C11H21N
SMILES
CCN(CC)CC1CCC=CC1
InChI
InChI=1S/C11H21N/c1-3-12(4-2)10-11-8-6-5-7-9-11/h5-6,11H,3-4,7-10H2,1-2H3
InChIKey
NESRNXFACJUDNH-UHFFFAOYSA-N
Compound name
N-(cyclohex-3-en-1-ylmethyl)-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.1674 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.17468 140.8
[M+Na]+ 190.15662 144.6
[M-H]- 166.16012 144.7
[M+NH4]+ 185.20122 161.6
[M+K]+ 206.13056 144.0
[M+H-H2O]+ 150.16466 134.4
[M+HCOO]- 212.16560 163.3
[M+CH3COO]- 226.18125 186.6
[M+Na-2H]- 188.14207 145.5
[M]+ 167.16685 139.1
[M]- 167.16795 139.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.