CID 24840857

Brn 3565573

Structural Information

Molecular Formula
C18H13ClN2O4
SMILES
COC1=CC=C(C=C1)C(=O)/C=C/2\C(=O)N(C(=N)O2)C3=CC=CC=C3Cl
InChI
InChI=1S/C18H13ClN2O4/c1-24-12-8-6-11(7-9-12)15(22)10-16-17(23)21(18(20)25-16)14-5-3-2-4-13(14)19/h2-10,20H,1H3/b16-10+,20-18?
InChIKey
RPPRWFBIVBRZQT-MSWOZKQMSA-N
Compound name
(5E)-3-(2-chlorophenyl)-2-imino-5-[2-(4-methoxyphenyl)-2-oxoethylidene]-1,3-oxazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

356.0564 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 357.06368 180.2
[M+Na]+ 379.04562 193.9
[M+NH4]+ 374.09022 186.3
[M+K]+ 395.01956 189.2
[M-H]- 355.04912 185.6
[M+Na-2H]- 377.03107 186.4
[M]+ 356.05585 183.7
[M]- 356.05695 183.7
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.