CID 179630

53798-73-5

Structural Information

Molecular Formula
C9H11NO2
SMILES
C1CC(OC1C2=CN=CC=C2)O
InChI
InChI=1S/C9H11NO2/c11-9-4-3-8(12-9)7-2-1-5-10-6-7/h1-2,5-6,8-9,11H,3-4H2
InChIKey
LHGVLZHIYVKZBT-UHFFFAOYSA-N
Compound name
5-pyridin-3-yloxolan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

165.07898 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.086256 132.5
[M+Na]+ 188.068198 139.7
[M-H]- 164.071704 137.1
[M+NH4]+ 183.112803 151.4
[M+K]+ 204.042138 138.7
[M+H-H2O]+ 148.076240 126.0
[M+HCOO]- 210.077181 153.3
[M+CH3COO]- 224.092831 172.7
[M+Na-2H]- 186.053646 138.4
[M]+ 165.07843142 130.3
[M]- 165.07952858 130.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.