CID 135741646

81998-07-4

Structural Information

Molecular Formula
C12H12N2O
SMILES
CC1=CC(=NC=C1)C2=NC=CC(=C2O)C
InChI
InChI=1S/C12H12N2O/c1-8-3-5-13-10(7-8)11-12(15)9(2)4-6-14-11/h3-7,15H,1-2H3
InChIKey
NXRMIHXTXPXGME-UHFFFAOYSA-N
Compound name
4-methyl-2-(4-methylpyridin-2-yl)pyridin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

200.09496 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.10224 144.1
[M+Na]+ 223.08418 160.2
[M+NH4]+ 218.12878 152.5
[M+K]+ 239.05812 152.7
[M-H]- 199.08768 147.7
[M+Na-2H]- 221.06963 153.7
[M]+ 200.09441 147.5
[M]- 200.09551 147.5
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