CID 21879628

6-bromo-n-methyl-2-naphthamide

Structural Information

Molecular Formula

C₁₂H₁₀BrNO

SMILES

CNC(=O)C1=CC2=C(C=C1)C=C(C=C2)Br

InChI

InChI=1S/C12H10BrNO/c1-14-12(15)10-3-2-9-7-11(13)5-4-8(9)6-10/h2-7H,1H3,(H,14,15)

InChIKey

HPUCFMPIKISIIO-UHFFFAOYSA-N

Compound name

6-bromo-N-methylnaphthalene-2-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 81
Patents: 262.99457 Da
Monoisotopic Mass: 3.1
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]+	264.00185	146.6
[M+Na]+	285.98379	151.0
[M+NH4]+	281.02839	152.3
[M+K]+	301.95773	150.0
[M-H]-	261.98729	148.7
[M+Na-2H]-	283.96924	151.1
[M]+	262.99402	146.7
[M]-	262.99512	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe