CID 21453601

1h-indazol-7-ol

Structural Information

Molecular Formula
C7H6N2O
SMILES
C1=CC2=C(C(=C1)O)NN=C2
InChI
InChI=1S/C7H6N2O/c10-6-3-1-2-5-4-8-9-7(5)6/h1-4,10H,(H,8,9)
InChIKey
VEDLFQPHHBOHIR-UHFFFAOYSA-N
Compound name
1H-indazol-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

175
Patents

134.04802 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.055296 122.4
[M+Na]+ 157.037238 133.4
[M-H]- 133.040744 122.6
[M+NH4]+ 152.081843 143.5
[M+K]+ 173.011178 129.6
[M+H-H2O]+ 117.045280 116.4
[M+HCOO]- 179.046221 144.5
[M+CH3COO]- 193.061871 136.7
[M+Na-2H]- 155.022686 131.8
[M]+ 134.04747142 121.9
[M]- 134.04856858 121.9
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