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: 19
Patents: 169.18304 Da
Monoisotopic Mass: 3.4
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]+	170.19032	142.8
[M+Na]+	192.17226	145.4
[M-H]-	168.17576	146.3
[M+NH4]+	187.21686	163.4
[M+K]+	208.14620	145.2
[M+H-H2O]+	152.18030	136.3
[M+HCOO]-	214.18124	163.8
[M+CH3COO]-	228.19689	186.9
[M+Na-2H]-	190.15771	146.4
[M]+	169.18249	139.6
[M]-	169.18359	139.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe