CID 371716

Nsc646165

Structural Information

Molecular Formula

C₉H₁₁NO₂

SMILES

CC(=O)N(CC1=CC=CC=C1)O

InChI

InChI=1S/C9H11NO2/c1-8(11)10(12)7-9-5-3-2-4-6-9/h2-6,12H,7H2,1H3

InChIKey

AXLWZCHBAVVXRU-UHFFFAOYSA-N

Compound name

N-benzyl-N-hydroxyacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 74
Patents: 165.07898 Da
Monoisotopic Mass: 0.7
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]+	166.08626	134.2
[M+Na]+	188.06820	140.5
[M-H]-	164.07170	137.9
[M+NH4]+	183.11280	154.3
[M+K]+	204.04214	139.9
[M+H-H2O]+	148.07624	128.1
[M+HCOO]-	210.07718	158.5
[M+CH3COO]-	224.09283	180.3
[M+Na-2H]-	186.05365	140.2
[M]+	165.07843	134.1
[M]-	165.07953	134.1

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.