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
4
Annotation Hits

7
References

35169
Patents

173.1892 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 174.19648 144.1
[M+Na]+ 196.17842 151.8
[M+NH4]+ 191.22302 152.1
[M+K]+ 212.15236 146.8
[M-H]- 172.18192 146.3
[M+Na-2H]- 194.16387 148.2
[M]+ 173.18865 145.5
[M]- 173.18975 145.5
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