CID 696305

Benzamide, n-2-benzothiazolyl-2-hydroxy-

Structural Information

Molecular Formula

C₁₄H₁₀N₂O₂S

SMILES

C1=CC=C(C(=C1)C(=O)NC2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C14H10N2O2S/c17-11-7-3-1-5-9(11)13(18)16-14-15-10-6-2-4-8-12(10)19-14/h1-8,17H,(H,15,16,18)

InChIKey

DUTZWMOREYSZIY-UHFFFAOYSA-N

Compound name

N-(1,3-benzothiazol-2-yl)-2-hydroxybenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 270.0463 Da
Monoisotopic Mass: 3.7
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]+	271.053576	156.9
[M+Na]+	293.035518	166.9
[M-H]-	269.039024	163.1
[M+NH4]+	288.080123	174.5
[M+K]+	309.009458	161.5
[M+H-H2O]+	253.043560	150.1
[M+HCOO]-	315.044501	176.3
[M+CH3COO]-	329.060151	169.5
[M+Na-2H]-	291.020966	161.5
[M]+	270.04575142	159.8
[M]-	270.04684858	159.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe