CID 23279716

4-(4-ethoxyphenyl)-2,3-dihydro-1,3-thiazol-2-one

Structural Information

Molecular Formula
C11H11NO2S
SMILES
CCOC1=CC=C(C=C1)C2=CSC(=O)N2
InChI
InChI=1S/C11H11NO2S/c1-2-14-9-5-3-8(4-6-9)10-7-15-11(13)12-10/h3-7H,2H2,1H3,(H,12,13)
InChIKey
TVGUPWQGBAACQI-UHFFFAOYSA-N
Compound name
4-(4-ethoxyphenyl)-3H-1,3-thiazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.05106 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.05834 147.0
[M+Na]+ 244.04028 160.1
[M+NH4]+ 239.08488 155.6
[M+K]+ 260.01422 153.1
[M-H]- 220.04378 150.0
[M+Na-2H]- 242.02573 154.1
[M]+ 221.05051 150.2
[M]- 221.05161 150.2
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.