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

13
Patents

232.09602 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.10330 149.9
[M+Na]+ 255.08524 158.6
[M-H]- 231.08874 154.2
[M+NH4]+ 250.12984 166.0
[M+K]+ 271.05918 155.5
[M+H-H2O]+ 215.09328 141.5
[M+HCOO]- 277.09422 174.0
[M+CH3COO]- 291.10987 194.7
[M+Na-2H]- 253.07069 152.7
[M]+ 232.09547 149.1
[M]- 232.09657 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