CID 102145

1,4-cyclohexanebis(methylamine), n,n'-bis(4-methylbenzyl)-, dihydrochloride

Structural Information

Molecular Formula
C24H34N2
SMILES
CC1=CC=C(C=C1)CNCC2CCC(CC2)CNCC3=CC=C(C=C3)C
InChI
InChI=1S/C24H34N2/c1-19-3-7-21(8-4-19)15-25-17-23-11-13-24(14-12-23)18-26-16-22-9-5-20(2)6-10-22/h3-10,23-26H,11-18H2,1-2H3
InChIKey
ORHNNMLLJFVBOP-UHFFFAOYSA-N
Compound name
N-[(4-methylphenyl)methyl]-1-[4-[[(4-methylphenyl)methylamino]methyl]cyclohexyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

350.2722 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 351.27948 193.0
[M+Na]+ 373.26142 205.7
[M+NH4]+ 368.30602 202.0
[M+K]+ 389.23536 194.9
[M-H]- 349.26492 201.6
[M+Na-2H]- 371.24687 202.1
[M]+ 350.27165 197.3
[M]- 350.27275 197.3
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

patents stripe