CID 14523536

3,5-dimethoxy-n-methylaniline hydrochloride

Structural Information

Molecular Formula

C₉H₁₃NO₂

SMILES

CNC1=CC(=CC(=C1)OC)OC

InChI

InChI=1S/C9H13NO2/c1-10-7-4-8(11-2)6-9(5-7)12-3/h4-6,10H,1-3H3

InChIKey

DZJRIEASIKLRQK-UHFFFAOYSA-N

Compound name

3,5-dimethoxy-N-methylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 141
Patents: 167.09464 Da
Monoisotopic Mass: 1.8
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]+	168.10192	134.1
[M+Na]+	190.08386	146.6
[M+NH4]+	185.12846	142.7
[M+K]+	206.05780	140.4
[M-H]-	166.08736	136.8
[M+Na-2H]-	188.06931	141.2
[M]+	167.09409	136.6
[M]-	167.09519	136.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe