CID 120536

1h-indazol-3-ol, 1-(p-methoxybenzyl)-

Structural Information

Molecular Formula
C15H14N2O2
SMILES
COC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)N2
InChI
InChI=1S/C15H14N2O2/c1-19-12-8-6-11(7-9-12)10-17-14-5-3-2-4-13(14)15(18)16-17/h2-9H,10H2,1H3,(H,16,18)
InChIKey
BMKYHARYHCUVDW-UHFFFAOYSA-N
Compound name
1-[(4-methoxyphenyl)methyl]-2H-indazol-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

254.10553 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.112806 155.6
[M+Na]+ 277.094748 166.6
[M-H]- 253.098254 160.4
[M+NH4]+ 272.139353 172.4
[M+K]+ 293.068688 161.0
[M+H-H2O]+ 237.102790 147.4
[M+HCOO]- 299.103731 178.1
[M+CH3COO]- 313.119381 168.5
[M+Na-2H]- 275.080196 161.8
[M]+ 254.10498142 158.5
[M]- 254.10607858 158.5
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