CID 54432181

2-(1,2-oxazol-5-yl)pyridine

Structural Information

Molecular Formula
C8H6N2O
SMILES
C1=CC=NC(=C1)C2=CC=NO2
InChI
InChI=1S/C8H6N2O/c1-2-5-9-7(3-1)8-4-6-10-11-8/h1-6H
InChIKey
HWJIRKAEXNLKKQ-UHFFFAOYSA-N
Compound name
5-pyridin-2-yl-1,2-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

146.04802 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.055296 125.1
[M+Na]+ 169.037238 134.4
[M-H]- 145.040744 130.0
[M+NH4]+ 164.081843 143.9
[M+K]+ 185.011178 133.5
[M+H-H2O]+ 129.045280 117.4
[M+HCOO]- 191.046221 149.0
[M+CH3COO]- 205.061871 139.8
[M+Na-2H]- 167.022686 134.5
[M]+ 146.04747142 125.9
[M]- 146.04856858 125.9
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