CID 214984

34725-05-8

Structural Information

Molecular Formula
C12H13ClN2O3
SMILES
CCNC(=O)N1CC(OC1=O)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C12H13ClN2O3/c1-2-14-11(16)15-7-10(18-12(15)17)8-3-5-9(13)6-4-8/h3-6,10H,2,7H2,1H3,(H,14,16)
InChIKey
ZOYXERPBGMQCJU-UHFFFAOYSA-N
Compound name
5-(4-chlorophenyl)-N-ethyl-2-oxo-1,3-oxazolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

268.06146 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.06874 159.6
[M+Na]+ 291.05068 167.9
[M-H]- 267.05418 165.8
[M+NH4]+ 286.09528 175.9
[M+K]+ 307.02462 164.8
[M+H-H2O]+ 251.05872 152.9
[M+HCOO]- 313.05966 176.7
[M+CH3COO]- 327.07531 195.5
[M+Na-2H]- 289.03613 161.5
[M]+ 268.06091 161.6
[M]- 268.06201 161.6
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.