CID 66053

N,n-dimethylethylenediamine

Structural Information

Molecular Formula
C4H12N2
SMILES
CN(C)CCN
InChI
InChI=1S/C4H12N2/c1-6(2)4-3-5/h3-5H2,1-2H3
InChIKey
DILRJUIACXKSQE-UHFFFAOYSA-N
Compound name
N',N'-dimethylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

65
References

42306
Patents

88.10005 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.107326 117.2
[M+Na]+ 111.08927 126.5
[M+NH4]+ 106.13387 125.9
[M+K]+ 127.06321 121.5
[M-H]- 87.092774 118.5
[M+Na-2H]- 109.07472 122.0
[M]+ 88.099501 118.6
[M]- 88.100599 118.6
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