CID 732232

2-(3-phenyl-2-propenylidene)-5,6-dihydroimidazo(2,1-b)(1,3)thiazol-3(2h)-one

Structural Information

Molecular Formula
C14H12N2OS
SMILES
C1CN2C(=O)/C(=C/C=C/C3=CC=CC=C3)/SC2=N1
InChI
InChI=1S/C14H12N2OS/c17-13-12(18-14-15-9-10-16(13)14)8-4-7-11-5-2-1-3-6-11/h1-8H,9-10H2/b7-4+,12-8-
InChIKey
XHLPINSEHAYUJB-JHLWKMQHSA-N
Compound name
(2Z)-2-[(E)-3-phenylprop-2-enylidene]-5,6-dihydroimidazo[2,1-b][1,3]thiazol-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

256.06705 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.074326 157.9
[M+Na]+ 279.056268 169.8
[M-H]- 255.059774 164.3
[M+NH4]+ 274.100873 178.1
[M+K]+ 295.030208 163.9
[M+H-H2O]+ 239.064310 151.3
[M+HCOO]- 301.065251 177.3
[M+CH3COO]- 315.080901 171.3
[M+Na-2H]- 277.041716 158.7
[M]+ 256.06650142 161.3
[M]- 256.06759858 161.3
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

patents stripe