CID 216922

37853-37-5

Structural Information

Molecular Formula
C9H7ClN2O3
SMILES
C1=COC(=C1)C2=NOC(=C2)NC(=O)CCl
InChI
InChI=1S/C9H7ClN2O3/c10-5-8(13)11-9-4-6(12-15-9)7-2-1-3-14-7/h1-4H,5H2,(H,11,13)
InChIKey
OQQBICHQNZEJCC-UHFFFAOYSA-N
Compound name
2-chloro-N-[3-(furan-2-yl)-1,2-oxazol-5-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.01453 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.02181 144.0
[M+Na]+ 249.00375 156.5
[M+NH4]+ 244.04835 151.4
[M+K]+ 264.97769 155.3
[M-H]- 225.00725 148.6
[M+Na-2H]- 246.98920 150.3
[M]+ 226.01398 147.2
[M]- 226.01508 147.2
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.