CID 4602

Osalmid

Structural Information

Molecular Formula

C₁₃H₁₁NO₃

SMILES

C1=CC=C(C(=C1)C(=O)NC2=CC=C(C=C2)O)O

InChI

InChI=1S/C13H11NO3/c15-10-7-5-9(6-8-10)14-13(17)11-3-1-2-4-12(11)16/h1-8,15-16H,(H,14,17)

InChIKey

LGCMKPRGGJRYGM-UHFFFAOYSA-N

Compound name

2-hydroxy-N-(4-hydroxyphenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 20
References: 2154
Patents: 229.0739 Da
Monoisotopic Mass: 2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	230.081176	148.5
[M+Na]+	252.063118	155.6
[M-H]-	228.066624	153.1
[M+NH4]+	247.107723	164.7
[M+K]+	268.037058	151.8
[M+H-H2O]+	212.071160	141.6
[M+HCOO]-	274.072101	171.1
[M+CH3COO]-	288.087751	186.9
[M+Na-2H]-	250.048566	154.0
[M]+	229.07335142	146.5
[M]-	229.07444858	146.5

Literature stripe

literature stripe

Patent stripe

patents stripe