CID 141099531

N-[(1r)-2-amino-2-oxo-1-phenylethyl]-2-oxoimidazolidine-1-carboxamide

Structural Information

Molecular Formula
C12H14N4O3
SMILES
C1CN(C(=O)N1)C(=O)N[C@H](C2=CC=CC=C2)C(=O)N
InChI
InChI=1S/C12H14N4O3/c13-10(17)9(8-4-2-1-3-5-8)15-12(19)16-7-6-14-11(16)18/h1-5,9H,6-7H2,(H2,13,17)(H,14,18)(H,15,19)/t9-/m1/s1
InChIKey
WRFOQYJBSHXMAE-SECBINFHSA-N
Compound name
N-[(1R)-2-amino-2-oxo-1-phenylethyl]-2-oxoimidazolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.1066 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.113876 158.3
[M+Na]+ 285.095818 162.1
[M-H]- 261.099324 160.3
[M+NH4]+ 280.140423 171.6
[M+K]+ 301.069758 159.5
[M+H-H2O]+ 245.103860 149.6
[M+HCOO]- 307.104801 176.9
[M+CH3COO]- 321.120451 195.4
[M+Na-2H]- 283.081266 158.5
[M]+ 262.10605142 151.9
[M]- 262.10714858 151.9
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.