CID 121552657

Rac-(2r,3s)-2-ethenyloxolane-3-carboxylic acid

Structural Information

Molecular Formula
C7H10O3
SMILES
C=C[C@H]1[C@@H](CCO1)C(=O)O
InChI
InChI=1S/C7H10O3/c1-2-6-5(7(8)9)3-4-10-6/h2,5-6H,1,3-4H2,(H,8,9)/t5-,6+/m1/s1
InChIKey
DVVWRMUXPXCIBJ-RITPCOANSA-N
Compound name
(2S,3R)-2-ethenyloxolane-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.06299 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.07027 128.2
[M+Na]+ 165.05221 135.1
[M-H]- 141.05571 130.9
[M+NH4]+ 160.09681 149.4
[M+K]+ 181.02615 135.0
[M+H-H2O]+ 125.06025 123.8
[M+HCOO]- 187.06119 148.8
[M+CH3COO]- 201.07684 169.7
[M+Na-2H]- 163.03766 131.9
[M]+ 142.06244 126.6
[M]- 142.06354 126.6
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.