CID 9578542

Brn 1223545

Structural Information

Molecular Formula
C19H18N2O3S
SMILES
COC1=CC(=CC(=C1OC)OC)/C=N/C2=NC(=CS2)C3=CC=CC=C3
InChI
InChI=1S/C19H18N2O3S/c1-22-16-9-13(10-17(23-2)18(16)24-3)11-20-19-21-15(12-25-19)14-7-5-4-6-8-14/h4-12H,1-3H3/b20-11+
InChIKey
GWIZOKPEHRPQPH-RGVLZGJSSA-N
Compound name
(E)-N-(4-phenyl-1,3-thiazol-2-yl)-1-(3,4,5-trimethoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

354.10382 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.11110 183.3
[M+Na]+ 377.09304 197.8
[M+NH4]+ 372.13764 191.3
[M+K]+ 393.06698 189.2
[M-H]- 353.09654 189.8
[M+Na-2H]- 375.07849 192.7
[M]+ 354.10327 187.8
[M]- 354.10437 187.8
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.