CID 44229278

N-methyl-1h,4h,5h,6h-cyclopenta[c]pyrazole-3-carboxamide

Structural Information

Molecular Formula
C8H11N3O
SMILES
CNC(=O)C1=NNC2=C1CCC2
InChI
InChI=1S/C8H11N3O/c1-9-8(12)7-5-3-2-4-6(5)10-11-7/h2-4H2,1H3,(H,9,12)(H,10,11)
InChIKey
TYDCMCXSYOEORK-UHFFFAOYSA-N
Compound name
N-methyl-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

165.09021 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.09749 135.3
[M+Na]+ 188.07943 142.9
[M-H]- 164.08293 136.1
[M+NH4]+ 183.12403 156.8
[M+K]+ 204.05337 140.7
[M+H-H2O]+ 148.08747 128.6
[M+HCOO]- 210.08841 156.5
[M+CH3COO]- 224.10406 176.6
[M+Na-2H]- 186.06488 139.1
[M]+ 165.08966 132.6
[M]- 165.09076 132.6
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