CID 102002

1,4-cyclohexanebis(methylamine), n,n'-bis(3-norbornylmethyl)-, dihydrochloride, (e)-

Structural Information

Molecular Formula
C24H42N2
SMILES
C1CC(CCC1CNCC2CC3CCC2C3)CNCC4CC5CCC4C5
InChI
InChI=1S/C24H42N2/c1-2-18(14-26-16-24-12-20-6-8-22(24)10-20)4-3-17(1)13-25-15-23-11-19-5-7-21(23)9-19/h17-26H,1-16H2
InChIKey
CSXADVFNSFDICZ-UHFFFAOYSA-N
Compound name
N-(2-bicyclo[2.2.1]heptanylmethyl)-1-[4-[(2-bicyclo[2.2.1]heptanylmethylamino)methyl]cyclohexyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

358.3348 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 359.342076 189.4
[M+Na]+ 381.324018 187.6
[M-H]- 357.327524 195.5
[M+NH4]+ 376.368623 210.7
[M+K]+ 397.297958 182.1
[M+H-H2O]+ 341.332060 183.7
[M+HCOO]- 403.333001 203.1
[M+CH3COO]- 417.348651 196.3
[M+Na-2H]- 379.309466 181.9
[M]+ 358.33425142 181.4
[M]- 358.33534858 181.4
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.