CID 62170805

5-bromo-n-methyl-2-(methylamino)pyridine-3-carboxamide

Structural Information

Molecular Formula
C8H10BrN3O
SMILES
CNC1=C(C=C(C=N1)Br)C(=O)NC
InChI
InChI=1S/C8H10BrN3O/c1-10-7-6(8(13)11-2)3-5(9)4-12-7/h3-4H,1-2H3,(H,10,12)(H,11,13)
InChIKey
RLZQCFCVHMATDW-UHFFFAOYSA-N
Compound name
5-bromo-N-methyl-2-(methylamino)pyridine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.00072 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.007996 142.4
[M+Na]+ 265.989938 153.2
[M-H]- 241.993444 147.6
[M+NH4]+ 261.034543 161.8
[M+K]+ 281.963878 141.9
[M+H-H2O]+ 225.997980 140.5
[M+HCOO]- 287.998921 164.6
[M+CH3COO]- 302.014571 194.1
[M+Na-2H]- 263.975386 150.0
[M]+ 243.00017142 160.1
[M]- 243.00126858 160.1
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

No patent data available for this compound.