CID 22934018

6-methyl-1h-indazol-5-ol

Structural Information

Molecular Formula
C8H8N2O
SMILES
CC1=CC2=C(C=C1O)C=NN2
InChI
InChI=1S/C8H8N2O/c1-5-2-7-6(3-8(5)11)4-9-10-7/h2-4,11H,1H3,(H,9,10)
InChIKey
NTOBXXNRFCWTAH-UHFFFAOYSA-N
Compound name
6-methyl-1H-indazol-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

148.06366 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.070936 127.3
[M+Na]+ 171.052878 138.7
[M-H]- 147.056384 127.7
[M+NH4]+ 166.097483 148.1
[M+K]+ 187.026818 134.6
[M+H-H2O]+ 131.060920 121.4
[M+HCOO]- 193.061861 149.0
[M+CH3COO]- 207.077511 141.4
[M+Na-2H]- 169.038326 135.3
[M]+ 148.06311142 127.4
[M]- 148.06420858 127.4
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