CID 12237780

6,7-dimethoxynaphthalen-2-amine

Structural Information

Molecular Formula

C₁₂H₁₃NO₂

SMILES

COC1=C(C=C2C=C(C=CC2=C1)N)OC

InChI

InChI=1S/C12H13NO2/c1-14-11-6-8-3-4-10(13)5-9(8)7-12(11)15-2/h3-7H,13H2,1-2H3

InChIKey

JQGSFVRQRHRJRX-UHFFFAOYSA-N

Compound name

6,7-dimethoxynaphthalen-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 203.09464 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]+	204.10192	142.1
[M+Na]+	226.08386	156.2
[M+NH4]+	221.12846	151.5
[M+K]+	242.05780	149.1
[M-H]-	202.08736	146.0
[M+Na-2H]-	224.06931	149.4
[M]+	203.09409	145.3
[M]-	203.09519	145.3

Literature stripe

literature stripe

Patent stripe

patents stripe