CID 133412

4-(pyrazol-1-ylmethyl)phenol

Structural Information

Molecular Formula
C10H10N2O
SMILES
C1=CN(N=C1)CC2=CC=C(C=C2)O
InChI
InChI=1S/C10H10N2O/c13-10-4-2-9(3-5-10)8-12-7-1-6-11-12/h1-7,13H,8H2
InChIKey
SLCYYEKQDZIXOZ-UHFFFAOYSA-N
Compound name
4-(pyrazol-1-ylmethyl)phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

43
Patents

174.07932 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.08660 136.6
[M+Na]+ 197.06854 150.3
[M+NH4]+ 192.11314 145.0
[M+K]+ 213.04248 145.3
[M-H]- 173.07204 139.2
[M+Na-2H]- 195.05399 145.3
[M]+ 174.07877 139.2
[M]- 174.07987 139.2
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