CID 53399657

Ethyl 2-cyclobutyl-4-oxazolecarboxylate

Structural Information

Molecular Formula
C10H13NO3
SMILES
CCOC(=O)C1=COC(=N1)C2CCC2
InChI
InChI=1S/C10H13NO3/c1-2-13-10(12)8-6-14-9(11-8)7-4-3-5-7/h6-7H,2-5H2,1H3
InChIKey
DVTBGTTXQPVITL-UHFFFAOYSA-N
Compound name
ethyl 2-cyclobutyl-1,3-oxazole-4-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.08954 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.09682 135.7
[M+Na]+ 218.07876 141.4
[M-H]- 194.08226 141.6
[M+NH4]+ 213.12336 147.7
[M+K]+ 234.05270 144.9
[M+H-H2O]+ 178.08680 124.3
[M+HCOO]- 240.08774 156.5
[M+CH3COO]- 254.10339 185.0
[M+Na-2H]- 216.06421 139.9
[M]+ 195.08899 146.7
[M]- 195.09009 146.7
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.