CID 19855984

116884-63-0

Structural Information

Molecular Formula
C11H12N4O2
SMILES
COC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)N)N
InChI
InChI=1S/C11H12N4O2/c1-17-8-4-2-7(3-5-8)15-10(12)9(6-14-15)11(13)16/h2-6H,12H2,1H3,(H2,13,16)
InChIKey
JDFORGBQQYXPDM-UHFFFAOYSA-N
Compound name
5-amino-1-(4-methoxyphenyl)pyrazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

232.09602 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.103296 149.9
[M+Na]+ 255.085238 158.6
[M-H]- 231.088744 154.2
[M+NH4]+ 250.129843 166.0
[M+K]+ 271.059178 155.5
[M+H-H2O]+ 215.093280 141.5
[M+HCOO]- 277.094221 174.0
[M+CH3COO]- 291.109871 194.7
[M+Na-2H]- 253.070686 152.7
[M]+ 232.09547142 149.1
[M]- 232.09656858 149.1
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

patents stripe