CID 2891067

6222-06-6

Structural Information

Molecular Formula
C13H16N2O3
SMILES
C1CC1NC(=O)C(=O)NCC(C2=CC=CC=C2)O
InChI
InChI=1S/C13H16N2O3/c16-11(9-4-2-1-3-5-9)8-14-12(17)13(18)15-10-6-7-10/h1-5,10-11,16H,6-8H2,(H,14,17)(H,15,18)
InChIKey
ZEUJXQUVYKJZFV-UHFFFAOYSA-N
Compound name
N'-cyclopropyl-N-(2-hydroxy-2-phenylethyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

248.11609 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.123366 150.9
[M+Na]+ 271.105308 156.3
[M-H]- 247.108814 156.7
[M+NH4]+ 266.149913 161.8
[M+K]+ 287.079248 153.0
[M+H-H2O]+ 231.113350 143.9
[M+HCOO]- 293.114291 173.6
[M+CH3COO]- 307.129941 197.1
[M+Na-2H]- 269.090756 154.6
[M]+ 248.11554142 151.2
[M]- 248.11663858 151.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.