CID 21873716

(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-yl)methanol

Structural Information

Molecular Formula
C8H9NO3
SMILES
C1COC2=C(O1)C=CC(=N2)CO
InChI
InChI=1S/C8H9NO3/c10-5-6-1-2-7-8(9-6)12-4-3-11-7/h1-2,10H,3-5H2
InChIKey
QLKMUCAACLOULA-UHFFFAOYSA-N
Compound name
2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-ylmethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

167.05824 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.06552 131.9
[M+Na]+ 190.04746 145.2
[M+NH4]+ 185.09206 140.4
[M+K]+ 206.02140 140.1
[M-H]- 166.05096 136.0
[M+Na-2H]- 188.03291 137.0
[M]+ 167.05769 134.9
[M]- 167.05879 134.9
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