CID 2830272

2166-87-2

Structural Information

Molecular Formula
C15H13NO3
SMILES
C1=CC=C(C=C1)C(=O)C(NC(=O)C2=CC=CC=C2)O
InChI
InChI=1S/C15H13NO3/c17-13(11-7-3-1-4-8-11)15(19)16-14(18)12-9-5-2-6-10-12/h1-10,15,19H,(H,16,18)
InChIKey
JWVPVXMVKOSSRU-UHFFFAOYSA-N
Compound name
N-(1-hydroxy-2-oxo-2-phenylethyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

255.08954 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.09682 157.1
[M+Na]+ 278.07876 161.4
[M-H]- 254.08226 162.0
[M+NH4]+ 273.12336 171.9
[M+K]+ 294.05270 158.5
[M+H-H2O]+ 238.08680 149.3
[M+HCOO]- 300.08774 178.7
[M+CH3COO]- 314.10339 193.9
[M+Na-2H]- 276.06421 160.9
[M]+ 255.08899 154.8
[M]- 255.09009 154.8
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