CID 5415838

(5z)-3-(3-chlorophenyl)-5-(4-nitrobenzylidene)imidazolidine-2,4-dione

Structural Information

Molecular Formula
C16H10ClN3O4
SMILES
C1=CC(=CC(=C1)Cl)N2C(=O)/C(=C/C3=CC=C(C=C3)[N+](=O)[O-])/NC2=O
InChI
InChI=1S/C16H10ClN3O4/c17-11-2-1-3-13(9-11)19-15(21)14(18-16(19)22)8-10-4-6-12(7-5-10)20(23)24/h1-9H,(H,18,22)/b14-8-
InChIKey
CBXQEDFKXKSESN-ZSOIEALJSA-N
Compound name
(5Z)-3-(3-chlorophenyl)-5-[(4-nitrophenyl)methylidene]imidazolidine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

343.03598 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.04326 174.3
[M+Na]+ 366.02520 189.0
[M+NH4]+ 361.06980 180.3
[M+K]+ 381.99914 186.4
[M-H]- 342.02870 178.6
[M+Na-2H]- 364.01065 180.9
[M]+ 343.03543 177.5
[M]- 343.03653 177.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.