CID 80442

6268-05-9

Structural Information

Molecular Formula

C₁₅H₁₆N₂O₃

SMILES

COC1=CC(=C(C=C1N)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C15H16N2O3/c1-19-13-9-12(14(20-2)8-11(13)16)17-15(18)10-6-4-3-5-7-10/h3-9H,16H2,1-2H3,(H,17,18)

InChIKey

DDRCIGNRLHTTIW-UHFFFAOYSA-N

Compound name

N-(4-amino-2,5-dimethoxyphenyl)benzamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 1267
Patents: 272.1161 Da
Monoisotopic Mass: 2.0
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]+	273.12338	162.7
[M+Na]+	295.10532	175.0
[M+NH4]+	290.14992	169.8
[M+K]+	311.07926	168.9
[M-H]-	271.10882	167.3
[M+Na-2H]-	293.09077	170.5
[M]+	272.11555	165.6
[M]-	272.11665	165.6

Literature stripe

literature stripe

Patent stripe

patents stripe