CID 3049620

Crl 40,468

Structural Information

Molecular Formula
C17H13Cl2N3O4
SMILES
C1=CC(=CC=C1C2(C(=O)N(C(=O)N2)CC(=O)NO)C3=CC=C(C=C3)Cl)Cl
InChI
InChI=1S/C17H13Cl2N3O4/c18-12-5-1-10(2-6-12)17(11-3-7-13(19)8-4-11)15(24)22(16(25)20-17)9-14(23)21-26/h1-8,26H,9H2,(H,20,25)(H,21,23)
InChIKey
SJIJCNSCFVIWBF-UHFFFAOYSA-N
Compound name
2-[4,4-bis(4-chlorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-hydroxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

393.02832 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 394.03560 184.1
[M+Na]+ 416.01754 193.3
[M-H]- 392.02104 188.9
[M+NH4]+ 411.06214 196.0
[M+K]+ 431.99148 185.9
[M+H-H2O]+ 376.02558 176.8
[M+HCOO]- 438.02652 192.9
[M+CH3COO]- 452.04217 212.9
[M+Na-2H]- 414.00299 183.9
[M]+ 393.02777 185.1
[M]- 393.02887 185.1
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

patents stripe