CID 70880

1161-44-0

Structural Information

Molecular Formula
C20H38N2
SMILES
C1CCC(CC1)NCC2CCC(CC2)CNC3CCCCC3
InChI
InChI=1S/C20H38N2/c1-3-7-19(8-4-1)21-15-17-11-13-18(14-12-17)16-22-20-9-5-2-6-10-20/h17-22H,1-16H2
InChIKey
YJIMWQRGXZCESL-UHFFFAOYSA-N
Compound name
N-[[4-[(cyclohexylamino)methyl]cyclohexyl]methyl]cyclohexanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.3035 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.31078 183.3
[M+Na]+ 329.29272 190.4
[M+NH4]+ 324.33732 192.5
[M+K]+ 345.26666 181.5
[M-H]- 305.29622 190.7
[M+Na-2H]- 327.27817 188.4
[M]+ 306.30295 186.0
[M]- 306.30405 186.0
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.