CID 68371

551-35-9

Structural Information

Molecular Formula

C₁₀H₁₃NO₂

SMILES

CC(C)NC(=O)C1=CC=CC=C1O

InChI

InChI=1S/C10H13NO2/c1-7(2)11-10(13)8-5-3-4-6-9(8)12/h3-7,12H,1-2H3,(H,11,13)

InChIKey

ZWIKMHMXRCCKQO-UHFFFAOYSA-N

Compound name

2-hydroxy-N-propan-2-ylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 29
Patents: 179.09464 Da
Monoisotopic Mass: 2.1
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]+	180.10192	138.9
[M+Na]+	202.08386	145.3
[M-H]-	178.08736	141.4
[M+NH4]+	197.12846	158.0
[M+K]+	218.05780	143.6
[M+H-H2O]+	162.09190	133.1
[M+HCOO]-	224.09284	161.3
[M+CH3COO]-	238.10849	182.0
[M+Na-2H]-	200.06931	143.1
[M]+	179.09409	137.7
[M]-	179.09519	137.7

Literature stripe

literature stripe

Patent stripe

patents stripe