CID 81829

1h-indazol-3-ol

Structural Information

Molecular Formula
C7H6N2O
SMILES
C1=CC=C2C(=C1)C(=O)NN2
InChI
InChI=1S/C7H6N2O/c10-7-5-3-1-2-4-6(5)8-9-7/h1-4H,(H2,8,9,10)
InChIKey
SWEICGMKXPNXNU-UHFFFAOYSA-N
Compound name
1,2-dihydroindazol-3-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

9
References

2255
Patents

134.04802 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.05530 122.8
[M+Na]+ 157.03724 136.5
[M+NH4]+ 152.08184 131.2
[M+K]+ 173.01118 132.1
[M-H]- 133.04074 123.3
[M+Na-2H]- 155.02269 129.7
[M]+ 134.04747 124.7
[M]- 134.04857 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