CID 10718

Calcium benzoylpas

Structural Information

Molecular Formula

C₁₄H₁₁NO₄

SMILES

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

InChI

InChI=1S/C14H11NO4/c16-12-8-10(6-7-11(12)14(18)19)15-13(17)9-4-2-1-3-5-9/h1-8,16H,(H,15,17)(H,18,19)

InChIKey

GNZCRYWFWKFIDM-UHFFFAOYSA-N

Compound name

4-benzamido-2-hydroxybenzoic acid

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 24
References: 1371
Patents: 257.06882 Da
Monoisotopic Mass: 3.3
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]+	258.07610	156.7
[M+Na]+	280.05804	168.5
[M+NH4]+	275.10264	163.0
[M+K]+	296.03198	163.7
[M-H]-	256.06154	159.2
[M+Na-2H]-	278.04349	163.6
[M]+	257.06827	158.8
[M]-	257.06937	158.8

Literature stripe

literature stripe

Patent stripe

patents stripe