CID 69378094

[2-amino-2-(pyridin-3-yl)ethyl]dimethylamine trihydrochloride

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

10
Patents

165.1266 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 137.3
[M+Na]+ 188.115818 142.9
[M-H]- 164.119324 140.3
[M+NH4]+ 183.160423 156.3
[M+K]+ 204.089758 142.3
[M+H-H2O]+ 148.123860 129.8
[M+HCOO]- 210.124801 161.5
[M+CH3COO]- 224.140451 187.4
[M+Na-2H]- 186.101266 143.2
[M]+ 165.12605142 135.9
[M]- 165.12714858 135.9
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