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]+ 257.07433 157.9
[M+Na]+ 279.05627 169.8
[M-H]- 255.05977 164.3
[M+NH4]+ 274.10087 178.1
[M+K]+ 295.03021 163.9
[M+H-H2O]+ 239.06431 151.3
[M+HCOO]- 301.06525 177.3
[M+CH3COO]- 315.08090 171.3
[M+Na-2H]- 277.04172 158.7
[M]+ 256.06650 161.3
[M]- 256.06760 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

No patent data available for this compound.