CID 547434

3-methoxy-n,n-dimethylbenzylamine

Structural Information

Molecular Formula

C₁₀H₁₅NO

SMILES

CN(C)CC1=CC(=CC=C1)OC

InChI

InChI=1S/C10H15NO/c1-11(2)8-9-5-4-6-10(7-9)12-3/h4-7H,8H2,1-3H3

InChIKey

IENUHHADGQLQLU-UHFFFAOYSA-N

Compound name

1-(3-methoxyphenyl)-N,N-dimethylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 125
Patents: 165.11537 Da
Monoisotopic Mass: 1.9
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]+	166.12265	135.6
[M+Na]+	188.10459	148.3
[M+NH4]+	183.14919	144.9
[M+K]+	204.07853	141.5
[M-H]-	164.10809	139.2
[M+Na-2H]-	186.09004	143.5
[M]+	165.11482	138.4
[M]-	165.11592	138.4

Literature stripe

literature stripe

Patent stripe

patents stripe