CID 21912013

2-(1h-pyrazol-3-yl)acetamide

Structural Information

Molecular Formula
C5H7N3O
SMILES
C1=C(NN=C1)CC(=O)N
InChI
InChI=1S/C5H7N3O/c6-5(9)3-4-1-2-7-8-4/h1-2H,3H2,(H2,6,9)(H,7,8)
InChIKey
QJWOKJCUJXCWGT-UHFFFAOYSA-N
Compound name
2-(1H-pyrazol-5-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

80
Patents

125.058914 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.06619 124.0
[M+Na]+ 148.04813 133.3
[M+NH4]+ 143.09274 130.8
[M+K]+ 164.02207 131.2
[M-H]- 124.05164 123.3
[M+Na-2H]- 146.03358 128.6
[M]+ 125.05837 124.6
[M]- 125.05946 124.6
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