CID 124103

523-68-2

Structural Information

Molecular Formula

C₁₃H₁₃NO₂

SMILES

CC1=C(C2=CC=CC=C2C(=C1)NC(=O)C)O

InChI

InChI=1S/C13H13NO2/c1-8-7-12(14-9(2)15)10-5-3-4-6-11(10)13(8)16/h3-7,16H,1-2H3,(H,14,15)

InChIKey

WBCVLLLKWZXXBK-UHFFFAOYSA-N

Compound name

N-(4-hydroxy-3-methylnaphthalen-1-yl)acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 60
Patents: 215.09464 Da
Monoisotopic Mass: 2.4
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]+	216.10192	146.5
[M+Na]+	238.08386	159.8
[M+NH4]+	233.12846	155.0
[M+K]+	254.05780	153.2
[M-H]-	214.08736	149.4
[M+Na-2H]-	236.06931	152.9
[M]+	215.09409	149.2
[M]-	215.09519	149.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe