CID 45361771

(5,6-dimethoxypyridin-2-yl)methanol

Structural Information

Molecular Formula

C₈H₁₁NO₃

SMILES

COC1=C(N=C(C=C1)CO)OC

InChI

InChI=1S/C8H11NO3/c1-11-7-4-3-6(5-10)9-8(7)12-2/h3-4,10H,5H2,1-2H3

InChIKey

FASQBELOVBMULV-UHFFFAOYSA-N

Compound name

(5,6-dimethoxypyridin-2-yl)methanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 169.0739 Da
Monoisotopic Mass: 0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	170.08118	133.6
[M+Na]+	192.06312	146.4
[M+NH4]+	187.10772	141.1
[M+K]+	208.03706	141.0
[M-H]-	168.06662	134.3
[M+Na-2H]-	190.04857	139.8
[M]+	169.07335	135.5
[M]-	169.07445	135.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe