CID 67273

3-hydroxy-2'-methyl-2-naphthanilide

Structural Information

Molecular Formula

C₁₈H₁₅NO₂

SMILES

CC1=CC=CC=C1NC(=O)C2=CC3=CC=CC=C3C=C2O

InChI

InChI=1S/C18H15NO2/c1-12-6-2-5-9-16(12)19-18(21)15-10-13-7-3-4-8-14(13)11-17(15)20/h2-11,20H,1H3,(H,19,21)

InChIKey

FBLAHUMENIHUGG-UHFFFAOYSA-N

Compound name

3-hydroxy-N-(2-methylphenyl)naphthalene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 504
Patents: 277.1103 Da
Monoisotopic Mass: 4.6
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]+	278.11758	162.8
[M+Na]+	300.09952	170.4
[M-H]-	276.10302	169.4
[M+NH4]+	295.14412	178.8
[M+K]+	316.07346	165.2
[M+H-H2O]+	260.10756	155.0
[M+HCOO]-	322.10850	184.7
[M+CH3COO]-	336.12415	174.5
[M+Na-2H]-	298.08497	168.6
[M]+	277.10975	162.1
[M]-	277.11085	162.1

Literature stripe

literature stripe

Patent stripe

patents stripe