CID 3079174

124500-06-7

Structural Information

Molecular Formula
C11H10ClNO3
SMILES
C1C(C(=O)OC1C2=CC=C(C=C2)Cl)C(=O)N
InChI
InChI=1S/C11H10ClNO3/c12-7-3-1-6(2-4-7)9-5-8(10(13)14)11(15)16-9/h1-4,8-9H,5H2,(H2,13,14)
InChIKey
ACQYMHFVZONQTB-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-2-oxooxolane-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

239.03493 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.042206 150.9
[M+Na]+ 262.024148 159.6
[M-H]- 238.027654 158.2
[M+NH4]+ 257.068753 169.4
[M+K]+ 277.998088 156.4
[M+H-H2O]+ 222.032190 145.6
[M+HCOO]- 284.033131 169.0
[M+CH3COO]- 298.048781 190.5
[M+Na-2H]- 260.009596 152.5
[M]+ 239.03438142 151.3
[M]- 239.03547858 151.3
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.