CID 62170805

1250795-17-5

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]+ 244.00800 144.8
[M+Na]+ 265.98994 146.8
[M+NH4]+ 261.03454 148.6
[M+K]+ 281.96388 147.5
[M-H]- 241.99344 145.3
[M+Na-2H]- 263.97539 147.9
[M]+ 243.00017 143.8
[M]- 243.00127 143.8
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.