CID 22934041

N-methyl-1h-indazole-5-carboxamide

Structural Information

Molecular Formula
C9H9N3O
SMILES
CNC(=O)C1=CC2=C(C=C1)NN=C2
InChI
InChI=1S/C9H9N3O/c1-10-9(13)6-2-3-8-7(4-6)5-11-12-8/h2-5H,1H3,(H,10,13)(H,11,12)
InChIKey
CSTBSTICBFYTGJ-UHFFFAOYSA-N
Compound name
N-methyl-1H-indazole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

175.07455 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.08183 134.5
[M+Na]+ 198.06377 144.1
[M-H]- 174.06727 135.8
[M+NH4]+ 193.10837 154.1
[M+K]+ 214.03771 140.5
[M+H-H2O]+ 158.07181 127.5
[M+HCOO]- 220.07275 157.6
[M+CH3COO]- 234.08840 178.6
[M+Na-2H]- 196.04922 142.5
[M]+ 175.07400 134.3
[M]- 175.07510 134.3
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