CID 854039

2,6-pyridinedicarboxamide

Structural Information

Molecular Formula
C7H7N3O2
SMILES
C1=CC(=NC(=C1)C(=O)N)C(=O)N
InChI
InChI=1S/C7H7N3O2/c8-6(11)4-2-1-3-5(10-4)7(9)12/h1-3H,(H2,8,11)(H2,9,12)
InChIKey
UUVCRNTVNKTNRK-UHFFFAOYSA-N
Compound name
pyridine-2,6-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

36
References

478
Patents

165.05383 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.06111 132.4
[M+Na]+ 188.04305 139.9
[M-H]- 164.04655 134.3
[M+NH4]+ 183.08765 150.4
[M+K]+ 204.01699 138.4
[M+H-H2O]+ 148.05109 125.6
[M+HCOO]- 210.05203 156.0
[M+CH3COO]- 224.06768 181.8
[M+Na-2H]- 186.02850 137.1
[M]+ 165.05328 129.2
[M]- 165.05438 129.2
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