CID 3018099

N,n-bis(3-aminopropyl)-n',n'-dimethylpropane-1,3-diamine

Structural Information

Molecular Formula
C11H28N4
SMILES
CN(C)CCCN(CCCN)CCCN
InChI
InChI=1S/C11H28N4/c1-14(2)8-5-11-15(9-3-6-12)10-4-7-13/h3-13H2,1-2H3
InChIKey
NDYOVCQABQIDNF-UHFFFAOYSA-N
Compound name
N'-(3-aminopropyl)-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

216.2314 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.23868 157.4
[M+Na]+ 239.22062 159.4
[M-H]- 215.22412 158.4
[M+NH4]+ 234.26522 175.5
[M+K]+ 255.19456 160.0
[M+H-H2O]+ 199.22866 149.6
[M+HCOO]- 261.22960 183.2
[M+CH3COO]- 275.24525 207.7
[M+Na-2H]- 237.20607 158.9
[M]+ 216.23085 157.7
[M]- 216.23195 157.7
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