CID 63091438

1341333-91-2

Structural Information

Molecular Formula
C8H13N3
SMILES
CNC1=C(N=CC=C1)N(C)C
InChI
InChI=1S/C8H13N3/c1-9-7-5-4-6-10-8(7)11(2)3/h4-6,9H,1-3H3
InChIKey
FDYNVUGZXKGSHY-UHFFFAOYSA-N
Compound name
2-N,2-N,3-N-trimethylpyridine-2,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

151.11095 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.118226 131.7
[M+Na]+ 174.100168 138.9
[M-H]- 150.103674 135.7
[M+NH4]+ 169.144773 151.9
[M+K]+ 190.074108 138.5
[M+H-H2O]+ 134.108210 124.6
[M+HCOO]- 196.109151 157.9
[M+CH3COO]- 210.124801 185.3
[M+Na-2H]- 172.085616 139.7
[M]+ 151.11040142 131.9
[M]- 151.11149858 131.9
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