CID 102695

1,4-cyclohexanebis(methylamine), n,n'-bis(5-norbornen-2-ylmethyl)-, dihydrochloride, trans-

Structural Information

Molecular Formula
C24H38N2
SMILES
C1CC(CCC1CNCC2CC3CC2C=C3)CNCC4CC5CC4C=C5
InChI
InChI=1S/C24H38N2/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/h5-8,17-26H,1-4,9-16H2
InChIKey
LRRNHPPLZGETJK-UHFFFAOYSA-N
Compound name
N-(2-bicyclo[2.2.1]hept-5-enylmethyl)-1-[4-[(2-bicyclo[2.2.1]hept-5-enylmethylamino)methyl]cyclohexyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.3035 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.31078 186.7
[M+Na]+ 377.29272 186.8
[M-H]- 353.29622 193.7
[M+NH4]+ 372.33732 208.4
[M+K]+ 393.26666 181.2
[M+H-H2O]+ 337.30076 181.0
[M+HCOO]- 399.30170 203.3
[M+CH3COO]- 413.31735 194.8
[M+Na-2H]- 375.27817 181.1
[M]+ 354.30295 181.6
[M]- 354.30405 181.6
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.