CID 18196

3030-47-5

Structural Information

Molecular Formula
C9H23N3
SMILES
CN(C)CCN(C)CCN(C)C
InChI
InChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3
InChIKey
UKODFQOELJFMII-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethyl]-N,N,N'-trimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

7
References

34807
Patents

173.1892 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.196476 145.7
[M+Na]+ 196.178418 149.6
[M-H]- 172.181924 149.8
[M+NH4]+ 191.223023 167.2
[M+K]+ 212.152358 152.7
[M+H-H2O]+ 156.186460 138.8
[M+HCOO]- 218.187401 173.0
[M+CH3COO]- 232.203051 201.6
[M+Na-2H]- 194.163866 149.4
[M]+ 173.18865142 149.5
[M]- 173.18974858 149.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe