CID 215112

(2-(p-chlorophenyl)-5-oxotetrahydro-2-furoyl)urea

Structural Information

Molecular Formula
C12H11ClN2O4
SMILES
C1CC(OC1=O)(C2=CC=C(C=C2)Cl)C(=O)NC(=O)N
InChI
InChI=1S/C12H11ClN2O4/c13-8-3-1-7(2-4-8)12(6-5-9(16)19-12)10(17)15-11(14)18/h1-4H,5-6H2,(H3,14,15,17,18)
InChIKey
GWABYXJNRYMHTH-UHFFFAOYSA-N
Compound name
N-carbamoyl-2-(4-chlorophenyl)-5-oxooxolane-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

282.04074 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.048016 160.7
[M+Na]+ 305.029958 168.0
[M-H]- 281.033464 167.9
[M+NH4]+ 300.074563 178.6
[M+K]+ 321.003898 165.5
[M+H-H2O]+ 265.038000 155.6
[M+HCOO]- 327.038941 179.0
[M+CH3COO]- 341.054591 198.2
[M+Na-2H]- 303.015406 163.2
[M]+ 282.04019142 160.7
[M]- 282.04128858 160.7
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.