CID 155820046

2470439-02-0

Structural Information

Molecular Formula
C8H11NO4
SMILES
CCOC(=O)C1=C(N=C(O1)CO)C
InChI
InChI=1S/C8H11NO4/c1-3-12-8(11)7-5(2)9-6(4-10)13-7/h10H,3-4H2,1-2H3
InChIKey
RUXGNALPPQMOKY-UHFFFAOYSA-N
Compound name
ethyl 2-(hydroxymethyl)-4-methyl-1,3-oxazole-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.0688 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.07608 138.1
[M+Na]+ 208.05802 148.4
[M+NH4]+ 203.10262 144.1
[M+K]+ 224.03196 147.0
[M-H]- 184.06152 138.1
[M+Na-2H]- 206.04347 140.8
[M]+ 185.06825 139.2
[M]- 185.06935 139.2
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.