CID 16226964

2-chloro-n-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide

Structural Information

Molecular Formula
C14H16ClN3O3
SMILES
CC1(C(=O)N(C(=O)N1)NC(=O)CCl)CCC2=CC=CC=C2
InChI
InChI=1S/C14H16ClN3O3/c1-14(8-7-10-5-3-2-4-6-10)12(20)18(13(21)16-14)17-11(19)9-15/h2-6H,7-9H2,1H3,(H,16,21)(H,17,19)
InChIKey
XFJUOGDKSPZMPZ-UHFFFAOYSA-N
Compound name
2-chloro-N-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.088 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.09528 168.2
[M+Na]+ 332.07722 176.1
[M-H]- 308.08072 171.0
[M+NH4]+ 327.12182 183.9
[M+K]+ 348.05116 170.6
[M+H-H2O]+ 292.08526 161.2
[M+HCOO]- 354.08620 183.0
[M+CH3COO]- 368.10185 201.1
[M+Na-2H]- 330.06267 169.5
[M]+ 309.08745 168.6
[M]- 309.08855 168.6
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.