CID 135511258

(2z)-2-[(e)-(3-methoxy-4-phenoxy-phenyl)methylenehydrazono]thiazolidin-4-one

Structural Information

Molecular Formula
C17H15N3O3S
SMILES
COC1=C(C=CC(=C1)/C=N/N=C\2/NC(=O)CS2)OC3=CC=CC=C3
InChI
InChI=1S/C17H15N3O3S/c1-22-15-9-12(10-18-20-17-19-16(21)11-24-17)7-8-14(15)23-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,20,21)/b18-10+
InChIKey
IWJJBBMTTVYQBT-VCHYOVAHSA-N
Compound name
(2Z)-2-[(E)-(3-methoxy-4-phenoxyphenyl)methylidenehydrazinylidene]-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

341.0834 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.09068 177.3
[M+Na]+ 364.07262 184.3
[M-H]- 340.07612 187.2
[M+NH4]+ 359.11722 191.5
[M+K]+ 380.04656 179.3
[M+H-H2O]+ 324.08066 168.0
[M+HCOO]- 386.08160 198.5
[M+CH3COO]- 400.09725 212.1
[M+Na-2H]- 362.05807 178.8
[M]+ 341.08285 179.3
[M]- 341.08395 179.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.