CID 11457913

90150-05-3

Structural Information

Molecular Formula
C11H23N
SMILES
CCN(CC)CC1CCCCC1
InChI
InChI=1S/C11H23N/c1-3-12(4-2)10-11-8-6-5-7-9-11/h11H,3-10H2,1-2H3
InChIKey
ZQXOWIRFHZAWFE-UHFFFAOYSA-N
Compound name
N-(cyclohexylmethyl)-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

169.18304 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.190316 142.8
[M+Na]+ 192.172258 145.4
[M-H]- 168.175764 146.3
[M+NH4]+ 187.216863 163.4
[M+K]+ 208.146198 145.2
[M+H-H2O]+ 152.180300 136.3
[M+HCOO]- 214.181241 163.8
[M+CH3COO]- 228.196891 186.9
[M+Na-2H]- 190.157706 146.4
[M]+ 169.18249142 139.6
[M]- 169.18358858 139.6
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

patents stripe