CID 520290

27151-57-1

Structural Information

Molecular Formula

C₁₅H₁₇NO₂

SMILES

CN(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H17NO2/c1-16(12-4-8-14(17-2)9-5-12)13-6-10-15(18-3)11-7-13/h4-11H,1-3H3

InChIKey

JBSYDIKKOAPATG-UHFFFAOYSA-N

Compound name

4-methoxy-N-(4-methoxyphenyl)-N-methylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3176
Patents: 243.12593 Da
Monoisotopic Mass: 3.5
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]+	244.133206	154.7
[M+Na]+	266.115148	161.9
[M-H]-	242.118654	163.0
[M+NH4]+	261.159753	172.6
[M+K]+	282.089088	160.3
[M+H-H2O]+	226.123190	146.7
[M+HCOO]-	288.124131	180.8
[M+CH3COO]-	302.139781	199.7
[M+Na-2H]-	264.100596	160.4
[M]+	243.12538142	158.3
[M]-	243.12647858	158.3

Literature stripe

literature stripe

Patent stripe

patents stripe