CID 18467999

19679-84-6

Structural Information

Molecular Formula
C11H12O3
SMILES
C1CC(OC1)(C2=CC=CC=C2)C(=O)O
InChI
InChI=1S/C11H12O3/c12-10(13)11(7-4-8-14-11)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,13)
InChIKey
XYCFRUQFTPLHSD-UHFFFAOYSA-N
Compound name
2-phenyloxolane-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

192.07864 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.08592 141.3
[M+Na]+ 215.06786 152.2
[M+NH4]+ 210.11246 150.9
[M+K]+ 231.04180 147.1
[M-H]- 191.07136 145.0
[M+Na-2H]- 213.05331 148.7
[M]+ 192.07809 143.9
[M]- 192.07919 143.9
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

patents stripe