CID 453488

2-methylpyridine deriv.

Structural Information

Molecular Formula
C11H13NO3
SMILES
CC1=C(N=CC=C1)C2=C[C@@H]([C@H](O2)CO)O
InChI
InChI=1S/C11H13NO3/c1-7-3-2-4-12-11(7)9-5-8(14)10(6-13)15-9/h2-5,8,10,13-14H,6H2,1H3/t8-,10+/m0/s1
InChIKey
WTZBTWFHHVSGIP-WCBMZHEXSA-N
Compound name
(2R,3S)-2-(hydroxymethyl)-5-(3-methylpyridin-2-yl)-2,3-dihydrofuran-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.08954 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 143.6
[M+Na]+ 230.07876 152.3
[M-H]- 206.08226 147.7
[M+NH4]+ 225.12336 160.7
[M+K]+ 246.05270 150.1
[M+H-H2O]+ 190.08680 137.3
[M+HCOO]- 252.08774 163.7
[M+CH3COO]- 266.10339 180.4
[M+Na-2H]- 228.06421 147.6
[M]+ 207.08899 143.9
[M]- 207.09009 143.9
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

No patent data available for this compound.