CID 737234

40535-14-6

Structural Information

Molecular Formula
C5H8N4O
SMILES
CC1=CC(=NN1)C(=O)NN
InChI
InChI=1S/C5H8N4O/c1-3-2-4(9-8-3)5(10)7-6/h2H,6H2,1H3,(H,7,10)(H,8,9)
InChIKey
FWNHUZOBVQZERU-UHFFFAOYSA-N
Compound name
5-methyl-1H-pyrazole-3-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

66
Patents

140.06981 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.07709 127.3
[M+Na]+ 163.05903 135.1
[M-H]- 139.06253 127.1
[M+NH4]+ 158.10363 146.6
[M+K]+ 179.03297 133.3
[M+H-H2O]+ 123.06707 120.2
[M+HCOO]- 185.06801 150.7
[M+CH3COO]- 199.08366 173.8
[M+Na-2H]- 161.04448 132.5
[M]+ 140.06926 123.4
[M]- 140.07036 123.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe