CID 20034952

71326-24-4

Structural Information

Molecular Formula
C7H19N3
SMILES
CN(C)CCNCCCN
InChI
InChI=1S/C7H19N3/c1-10(2)7-6-9-5-3-4-8/h9H,3-8H2,1-2H3
InChIKey
DDODLJWYWDHQFZ-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethyl]propane-1,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

145.1579 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.16518 135.4
[M+Na]+ 168.14712 139.7
[M-H]- 144.15062 136.2
[M+NH4]+ 163.19172 156.4
[M+K]+ 184.12106 140.2
[M+H-H2O]+ 128.15516 129.1
[M+HCOO]- 190.15610 161.7
[M+CH3COO]- 204.17175 187.7
[M+Na-2H]- 166.13257 140.6
[M]+ 145.15735 134.8
[M]- 145.15845 134.8
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