CID 11436748

(3-aminopropyl)dibenzylamine

Structural Information

Molecular Formula
C17H22N2
SMILES
C1=CC=C(C=C1)CN(CCCN)CC2=CC=CC=C2
InChI
InChI=1S/C17H22N2/c18-12-7-13-19(14-16-8-3-1-4-9-16)15-17-10-5-2-6-11-17/h1-6,8-11H,7,12-15,18H2
InChIKey
KXBUDXGDASOGBX-UHFFFAOYSA-N
Compound name
N',N'-dibenzylpropane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

139
Patents

254.1783 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.18558 163.4
[M+Na]+ 277.16752 176.1
[M+NH4]+ 272.21212 172.6
[M+K]+ 293.14146 167.0
[M-H]- 253.17102 170.0
[M+Na-2H]- 275.15297 173.4
[M]+ 254.17775 167.1
[M]- 254.17885 167.1
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