CID 97514

N'-[2-(dimethylamino)ethyl]-n,n-dimethylethylenediamine

Structural Information

Molecular Formula
C8H21N3
SMILES
CN(C)CCNCCN(C)C
InChI
InChI=1S/C8H21N3/c1-10(2)7-5-9-6-8-11(3)4/h9H,5-8H2,1-4H3
InChIKey
JPJMSWSYYHNPLD-UHFFFAOYSA-N
Compound name
N-[2-(dimethylamino)ethyl]-N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

763
Patents

159.17355 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.18083 140.7
[M+Na]+ 182.16277 144.7
[M-H]- 158.16627 143.4
[M+NH4]+ 177.20737 162.0
[M+K]+ 198.13671 146.7
[M+H-H2O]+ 142.17081 134.0
[M+HCOO]- 204.17175 167.7
[M+CH3COO]- 218.18740 195.0
[M+Na-2H]- 180.14822 145.6
[M]+ 159.17300 142.7
[M]- 159.17410 142.7
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

No patent data available for this compound.