CID 63345224

1342825-76-6

Structural Information

Molecular Formula
C9H9N3O2
SMILES
CC(C1=NC(=NO1)C2=CN=CC=C2)O
InChI
InChI=1S/C9H9N3O2/c1-6(13)9-11-8(12-14-9)7-3-2-4-10-5-7/h2-6,13H,1H3
InChIKey
GVIWSWSLVCHYRC-UHFFFAOYSA-N
Compound name
1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

191.06947 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.07675 139.1
[M+Na]+ 214.05869 152.3
[M+NH4]+ 209.10329 146.0
[M+K]+ 230.03263 149.6
[M-H]- 190.06219 141.5
[M+Na-2H]- 212.04414 146.3
[M]+ 191.06892 141.5
[M]- 191.07002 141.5
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

No patent data available for this compound.