CID 30445

N-(2-diethylaminoethyl)-1-benzylcyclohexylamine

Structural Information

Molecular Formula
C19H32N2
SMILES
CCN(CC)CCNC1(CCCCC1)CC2=CC=CC=C2
InChI
InChI=1S/C19H32N2/c1-3-21(4-2)16-15-20-19(13-9-6-10-14-19)17-18-11-7-5-8-12-18/h5,7-8,11-12,20H,3-4,6,9-10,13-17H2,1-2H3
InChIKey
IBYDSHWPPOMAPZ-UHFFFAOYSA-N
Compound name
N-(1-benzylcyclohexyl)-N',N'-diethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.25656 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.26384 176.0
[M+Na]+ 311.24578 185.9
[M+NH4]+ 306.29038 186.2
[M+K]+ 327.21972 175.1
[M-H]- 287.24928 182.1
[M+Na-2H]- 309.23123 184.7
[M]+ 288.25601 179.2
[M]- 288.25711 179.2
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.