CID 53445206

Methyl 2-fluorooxazole-4-carboxylate

Structural Information

Molecular Formula
C5H4FNO3
SMILES
COC(=O)C1=COC(=N1)F
InChI
InChI=1S/C5H4FNO3/c1-9-4(8)3-2-10-5(6)7-3/h2H,1H3
InChIKey
OBNGICGJVNVXMM-UHFFFAOYSA-N
Compound name
methyl 2-fluoro-1,3-oxazole-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.01752 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.02480 121.8
[M+Na]+ 168.00674 131.9
[M-H]- 144.01024 124.2
[M+NH4]+ 163.05134 142.6
[M+K]+ 183.98068 133.0
[M+H-H2O]+ 128.01478 115.5
[M+HCOO]- 190.01572 145.1
[M+CH3COO]- 204.03137 171.1
[M+Na-2H]- 165.99219 128.3
[M]+ 145.01697 124.2
[M]- 145.01807 124.2
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.