CID 215113

34971-21-6

Structural Information

Molecular Formula
C13H12Cl2O4
SMILES
C1CC(OC1=O)(C2=CC=C(C=C2)Cl)C(=O)OCCCl
InChI
InChI=1S/C13H12Cl2O4/c14-7-8-18-12(17)13(6-5-11(16)19-13)9-1-3-10(15)4-2-9/h1-4H,5-8H2
InChIKey
SQXCJOYBHWMRGU-UHFFFAOYSA-N
Compound name
2-chloroethyl 2-(4-chlorophenyl)-5-oxooxolane-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.01126 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.01854 160.8
[M+Na]+ 325.00048 173.4
[M+NH4]+ 320.04508 169.8
[M+K]+ 340.97442 166.9
[M-H]- 301.00398 164.0
[M+Na-2H]- 322.98593 167.4
[M]+ 302.01071 164.1
[M]- 302.01181 164.1
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.