CID 80488207

Akos019052141

Structural Information

Molecular Formula
C8H11NO3
SMILES
C1CC(C1)C2=NOC(C2)C(=O)O
InChI
InChI=1S/C8H11NO3/c10-8(11)7-4-6(9-12-7)5-2-1-3-5/h5,7H,1-4H2,(H,10,11)
InChIKey
WWKDUCSKXGQXSY-UHFFFAOYSA-N
Compound name
3-cyclobutyl-4,5-dihydro-1,2-oxazole-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

169.0739 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.08118 134.5
[M+Na]+ 192.06312 139.5
[M+NH4]+ 187.10772 137.7
[M+K]+ 208.03706 139.8
[M-H]- 168.06662 133.5
[M+Na-2H]- 190.04857 135.7
[M]+ 169.07335 133.4
[M]- 169.07445 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

No patent data available for this compound.