CID 193156

33451-85-3

Structural Information

Molecular Formula
C7H19N3
SMILES
CN(C)CCN(C)CCN
InChI
InChI=1S/C7H19N3/c1-9(2)6-7-10(3)5-4-8/h4-8H2,1-3H3
InChIKey
KRDDBYPPQLOAPV-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethyl]-N'-methylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

116
Patents

145.1579 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.16518 136.3
[M+Na]+ 168.14712 140.8
[M-H]- 144.15062 138.6
[M+NH4]+ 163.19172 157.9
[M+K]+ 184.12106 142.7
[M+H-H2O]+ 128.15516 129.8
[M+HCOO]- 190.15610 163.0
[M+CH3COO]- 204.17175 191.2
[M+Na-2H]- 166.13257 140.7
[M]+ 145.15735 136.9
[M]- 145.15845 136.9
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