CID 9550420

N-(4-chloro-2,5-dimethoxyphenyl)-5-(propan-2-yl)-1,2-oxazole-3-carboxamide

Structural Information

Molecular Formula
C15H17ClN2O4
SMILES
CC(C)C1=CC(=NO1)C(=O)NC2=CC(=C(C=C2OC)Cl)OC
InChI
InChI=1S/C15H17ClN2O4/c1-8(2)12-7-11(18-22-12)15(19)17-10-6-13(20-3)9(16)5-14(10)21-4/h5-8H,1-4H3,(H,17,19)
InChIKey
NQKWRELILZFNQJ-UHFFFAOYSA-N
Compound name
N-(4-chloro-2,5-dimethoxyphenyl)-5-propan-2-yl-1,2-oxazole-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

324.08768 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.09496 172.8
[M+Na]+ 347.07690 185.0
[M+NH4]+ 342.12150 178.9
[M+K]+ 363.05084 182.0
[M-H]- 323.08040 176.1
[M+Na-2H]- 345.06235 177.5
[M]+ 324.08713 175.6
[M]- 324.08823 175.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.