CID 217790

39630-03-0

Structural Information

Molecular Formula
C18H17N3O4
SMILES
C1C(CN(C1=O)C2=CC=CC=C2)C(=O)NC3=CC=CC=C3C(=O)NO
InChI
InChI=1S/C18H17N3O4/c22-16-10-12(11-21(16)13-6-2-1-3-7-13)17(23)19-15-9-5-4-8-14(15)18(24)20-25/h1-9,12,25H,10-11H2,(H,19,23)(H,20,24)
InChIKey
CYJDLMURDMXSHZ-UHFFFAOYSA-N
Compound name
N-[2-(hydroxycarbamoyl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

339.12192 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.129196 176.4
[M+Na]+ 362.111138 180.6
[M-H]- 338.114644 183.6
[M+NH4]+ 357.155743 188.1
[M+K]+ 378.085078 176.8
[M+H-H2O]+ 322.119180 167.2
[M+HCOO]- 384.120121 197.3
[M+CH3COO]- 398.135771 211.1
[M+Na-2H]- 360.096586 176.8
[M]+ 339.12137142 172.9
[M]- 339.12246858 172.9
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.