CID 3020163

84837-24-1

Structural Information

Molecular Formula

C₁₅H₁₇NO₂

SMILES

CC1=C(C=CC(=C1)NC2=CC=C(C=C2)OC)OC

InChI

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

InChIKey

RSMQZCBRDKTDEH-UHFFFAOYSA-N

Compound name

4-methoxy-N-(4-methoxyphenyl)-3-methylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 243.12593 Da
Monoisotopic Mass: 4.3
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	154.5
[M+Na]+	266.115148	162.5
[M-H]-	242.118654	161.8
[M+NH4]+	261.159753	172.1
[M+K]+	282.089088	159.6
[M+H-H2O]+	226.123190	146.9
[M+HCOO]-	288.124131	180.0
[M+CH3COO]-	302.139781	197.4
[M+Na-2H]-	264.100596	160.3
[M]+	243.12538142	157.3
[M]-	243.12647858	157.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe