CID 468661

1-methyl-1h-imidazole-5-carbohydrazide

Structural Information

Molecular Formula
C5H8N4O
SMILES
CN1C=NC=C1C(=O)NN
InChI
InChI=1S/C5H8N4O/c1-9-3-7-2-4(9)5(10)8-6/h2-3H,6H2,1H3,(H,8,10)
InChIKey
CFIAOJVURKEWPG-UHFFFAOYSA-N
Compound name
3-methylimidazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

20
Patents

140.06981 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.07709 126.7
[M+Na]+ 163.05903 135.0
[M-H]- 139.06253 127.9
[M+NH4]+ 158.10363 146.7
[M+K]+ 179.03297 134.0
[M+H-H2O]+ 123.06707 119.4
[M+HCOO]- 185.06801 151.6
[M+CH3COO]- 199.08366 176.2
[M+Na-2H]- 161.04448 132.4
[M]+ 140.06926 124.7
[M]- 140.07036 124.7
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