CID 69378094

2648944-85-6

Structural Information

Molecular Formula
C9H15N3
SMILES
CN(C)CC(C1=CN=CC=C1)N
InChI
InChI=1S/C9H15N3/c1-12(2)7-9(10)8-4-3-5-11-6-8/h3-6,9H,7,10H2,1-2H3
InChIKey
JLNVOFDRYDBRQK-UHFFFAOYSA-N
Compound name
N',N'-dimethyl-1-pyridin-3-ylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

165.1266 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.13388 136.9
[M+Na]+ 188.11582 147.6
[M+NH4]+ 183.16042 145.2
[M+K]+ 204.08976 142.1
[M-H]- 164.11932 139.8
[M+Na-2H]- 186.10127 144.0
[M]+ 165.12605 139.0
[M]- 165.12715 139.0
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