CID 89546977

3-(5-aminopyridin-2-yl)-1,3-oxazolidin-2-one

Structural Information

Molecular Formula
C8H9N3O2
SMILES
C1COC(=O)N1C2=NC=C(C=C2)N
InChI
InChI=1S/C8H9N3O2/c9-6-1-2-7(10-5-6)11-3-4-13-8(11)12/h1-2,5H,3-4,9H2
InChIKey
RWVFWCQUVAYWHT-UHFFFAOYSA-N
Compound name
3-(5-amino-2-pyridinyl)-1,3-oxazolidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

179.06947 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.076746 135.6
[M+Na]+ 202.058688 144.0
[M-H]- 178.062194 140.2
[M+NH4]+ 197.103293 152.8
[M+K]+ 218.032628 142.8
[M+H-H2O]+ 162.066730 127.8
[M+HCOO]- 224.067671 157.4
[M+CH3COO]- 238.083321 179.7
[M+Na-2H]- 200.044136 141.0
[M]+ 179.06892142 133.4
[M]- 179.07001858 133.4
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