CID 4662665

618092-44-7

Structural Information

Molecular Formula
C12H14N4O
SMILES
CC1=CC=C(C=C1)N2C(=C(C=N2)C(=O)NN)C
InChI
InChI=1S/C12H14N4O/c1-8-3-5-10(6-4-8)16-9(2)11(7-14-16)12(17)15-13/h3-7H,13H2,1-2H3,(H,15,17)
InChIKey
OLDCCJMGQXRSSP-UHFFFAOYSA-N
Compound name
5-methyl-1-(4-methylphenyl)pyrazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

230.11676 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.12404 151.8
[M+Na]+ 253.10598 160.3
[M-H]- 229.10948 156.5
[M+NH4]+ 248.15058 168.4
[M+K]+ 269.07992 156.7
[M+H-H2O]+ 213.11402 143.3
[M+HCOO]- 275.11496 175.9
[M+CH3COO]- 289.13061 195.4
[M+Na-2H]- 251.09143 155.0
[M]+ 230.11621 150.8
[M]- 230.11731 150.8
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