CID 77481

3875-01-2

Structural Information

Molecular Formula
C20H38N2
SMILES
C1CCC(C1)CNCC2CCC(CC2)CNCC3CCCC3
InChI
InChI=1S/C20H38N2/c1-2-6-17(5-1)13-21-15-19-9-11-20(12-10-19)16-22-14-18-7-3-4-8-18/h17-22H,1-16H2
InChIKey
UXKQDFBZTWMONI-UHFFFAOYSA-N
Compound name
1-cyclopentyl-N-[[4-[(cyclopentylmethylamino)methyl]cyclohexyl]methyl]methanamine
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 183.5
[M+Na]+ 329.29272 188.4
[M+NH4]+ 324.33732 192.2
[M+K]+ 345.26666 183.8
[M-H]- 305.29622 189.4
[M+Na-2H]- 327.27817 186.9
[M]+ 306.30295 185.4
[M]- 306.30405 185.4
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.