CID 4583115

618092-48-1

Structural Information

Molecular Formula
C11H11FN4O
SMILES
CC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)NN
InChI
InChI=1S/C11H11FN4O/c1-7-10(11(17)15-13)6-14-16(7)9-4-2-8(12)3-5-9/h2-6H,13H2,1H3,(H,15,17)
InChIKey
OFCSNCNPKUTYRE-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-5-methylpyrazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.09169 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.09897 149.5
[M+Na]+ 257.08091 158.4
[M-H]- 233.08441 152.9
[M+NH4]+ 252.12551 165.8
[M+K]+ 273.05485 154.6
[M+H-H2O]+ 217.08895 140.2
[M+HCOO]- 279.08989 172.9
[M+CH3COO]- 293.10554 195.1
[M+Na-2H]- 255.06636 152.7
[M]+ 234.09114 147.1
[M]- 234.09224 147.1
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.