CID 853504

634898-36-5

Structural Information

Molecular Formula
C11H10N4O3
SMILES
C1OC2=C(O1)C=C(C=C2)C3=NNC(=C3)C(=O)NN
InChI
InChI=1S/C11H10N4O3/c12-13-11(16)8-4-7(14-15-8)6-1-2-9-10(3-6)18-5-17-9/h1-4H,5,12H2,(H,13,16)(H,14,15)
InChIKey
MICQAFHYFMQRCZ-UHFFFAOYSA-N
Compound name
3-(1,3-benzodioxol-5-yl)-1H-pyrazole-5-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

246.07529 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 247.08257 152.6
[M+Na]+ 269.06451 162.0
[M+NH4]+ 264.10911 158.8
[M+K]+ 285.03845 162.8
[M-H]- 245.06801 156.8
[M+Na-2H]- 267.04996 155.9
[M]+ 246.07474 154.7
[M]- 246.07584 154.7
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.