CID 91654733

[3-(6-methylpyridazin-3-yl)phenyl]methanol

Structural Information

Molecular Formula
C12H12N2O
SMILES
CC1=NN=C(C=C1)C2=CC=CC(=C2)CO
InChI
InChI=1S/C12H12N2O/c1-9-5-6-12(14-13-9)11-4-2-3-10(7-11)8-15/h2-7,15H,8H2,1H3
InChIKey
OGQBNWOWGVLUDG-UHFFFAOYSA-N
Compound name
[3-(6-methylpyridazin-3-yl)phenyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.09496 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.102236 143.6
[M+Na]+ 223.084178 152.6
[M-H]- 199.087684 146.6
[M+NH4]+ 218.128783 159.5
[M+K]+ 239.058118 148.3
[M+H-H2O]+ 183.092220 135.3
[M+HCOO]- 245.093161 164.7
[M+CH3COO]- 259.108811 183.1
[M+Na-2H]- 221.069626 151.0
[M]+ 200.09441142 143.3
[M]- 200.09550858 143.3
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

No patent data available for this compound.