CID 64780835

1-(4-formylphenyl)-1h-pyrazole-4-carboxamide

Structural Information

Molecular Formula
C11H9N3O2
SMILES
C1=CC(=CC=C1C=O)N2C=C(C=N2)C(=O)N
InChI
InChI=1S/C11H9N3O2/c12-11(16)9-5-13-14(6-9)10-3-1-8(7-15)2-4-10/h1-7H,(H2,12,16)
InChIKey
FIBHVABVIVJEQX-UHFFFAOYSA-N
Compound name
1-(4-formylphenyl)pyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.06947 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.07675 146.2
[M+Na]+ 238.05869 158.2
[M+NH4]+ 233.10329 152.8
[M+K]+ 254.03263 154.8
[M-H]- 214.06219 148.2
[M+Na-2H]- 236.04414 153.2
[M]+ 215.06892 148.1
[M]- 215.07002 148.1
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.