CID 67160

123-67-1

Structural Information

Molecular Formula
C13H32N4
SMILES
CNCCCN(C)CCCN(C)CCCNC
InChI
InChI=1S/C13H32N4/c1-14-8-5-10-16(3)12-7-13-17(4)11-6-9-15-2/h14-15H,5-13H2,1-4H3
InChIKey
XRTKMBBIDHUQNP-UHFFFAOYSA-N
Compound name
N,N'-dimethyl-N'-[3-[methyl-[3-(methylamino)propyl]amino]propyl]propane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

244.2627 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.26998 165.2
[M+Na]+ 267.25192 170.5
[M+NH4]+ 262.29652 171.7
[M+K]+ 283.22586 164.5
[M-H]- 243.25542 167.0
[M+Na-2H]- 265.23737 167.6
[M]+ 244.26215 165.9
[M]- 244.26325 165.9
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