CID 22118661

193473-63-1

Structural Information

Molecular Formula
C8H13N3
SMILES
CNCCNC1=CC=CC=N1
InChI
InChI=1S/C8H13N3/c1-9-6-7-11-8-4-2-3-5-10-8/h2-5,9H,6-7H2,1H3,(H,10,11)
InChIKey
GHXWDWIQFQJWEQ-UHFFFAOYSA-N
Compound name
N-methyl-N'-pyridin-2-ylethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

44
Patents

151.11095 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 131.0
[M+Na]+ 174.100168 137.2
[M-H]- 150.103674 133.1
[M+NH4]+ 169.144773 150.2
[M+K]+ 190.074108 135.3
[M+H-H2O]+ 134.108210 123.8
[M+HCOO]- 196.109151 156.7
[M+CH3COO]- 210.124801 180.7
[M+Na-2H]- 172.085616 140.6
[M]+ 151.11040142 129.6
[M]- 151.11149858 129.6
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