CID 76963830

5-bromo-n-methyl-1h-pyrazole-3-carboxamide

Structural Information

Molecular Formula
C5H6BrN3O
SMILES
CNC(=O)C1=NNC(=C1)Br
InChI
InChI=1S/C5H6BrN3O/c1-7-5(10)3-2-4(6)9-8-3/h2H,1H3,(H,7,10)(H,8,9)
InChIKey
LOYJZLKXTLAMJX-UHFFFAOYSA-N
Compound name
5-bromo-N-methyl-1H-pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

0
Patents

202.96942 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.97670 139.5
[M+Na]+ 225.95864 140.3
[M+NH4]+ 221.00324 142.8
[M+K]+ 241.93258 143.3
[M-H]- 201.96214 137.8
[M+Na-2H]- 223.94409 140.8
[M]+ 202.96887 137.5
[M]- 202.96997 137.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

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Patent stripe

No patent data available for this compound.