CID 1909135

372975-62-7

Structural Information

Molecular Formula
C18H17ClN2OS
SMILES
COCCN1C(=CSC1=NC2=CC=CC=C2)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H17ClN2OS/c1-22-12-11-21-17(14-7-9-15(19)10-8-14)13-23-18(21)20-16-5-3-2-4-6-16/h2-10,13H,11-12H2,1H3
InChIKey
YIIXNFPPVSHCNJ-UHFFFAOYSA-N
Compound name
4-(4-chlorophenyl)-3-(2-methoxyethyl)-N-phenyl-1,3-thiazol-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.075 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.08228 179.2
[M+Na]+ 367.06422 195.4
[M+NH4]+ 362.10882 188.8
[M+K]+ 383.03816 184.7
[M-H]- 343.06772 186.6
[M+Na-2H]- 365.04967 189.9
[M]+ 344.07445 184.6
[M]- 344.07555 184.6
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.