CID 14137

Mandelamide, n-2-pyridyl-, hydrochloride

Structural Information

Molecular Formula
C13H12N2O2
SMILES
C1=CC=C(C=C1)C(C(=O)NC2=CC=CC=N2)O
InChI
InChI=1S/C13H12N2O2/c16-12(10-6-2-1-3-7-10)13(17)15-11-8-4-5-9-14-11/h1-9,12,16H,(H,14,15,17)
InChIKey
FPOGTSHZRWBREI-UHFFFAOYSA-N
Compound name
2-hydroxy-2-phenyl-N-pyridin-2-ylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

228.08987 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.097146 149.8
[M+Na]+ 251.079088 155.2
[M-H]- 227.082594 153.6
[M+NH4]+ 246.123693 164.7
[M+K]+ 267.053028 151.9
[M+H-H2O]+ 211.087130 141.5
[M+HCOO]- 273.088071 171.4
[M+CH3COO]- 287.103721 188.3
[M+Na-2H]- 249.064536 156.1
[M]+ 228.08932142 147.2
[M]- 228.09041858 147.2
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

patents stripe