CID 267535

N,3,4,5-tetramethoxy-n-methyl-benzamide

Structural Information

Molecular Formula

C₁₂H₁₇NO₅

SMILES

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

InChI

InChI=1S/C12H17NO5/c1-13(18-5)12(14)8-6-9(15-2)11(17-4)10(7-8)16-3/h6-7H,1-5H3

InChIKey

DJECVTFEJVBYHR-UHFFFAOYSA-N

Compound name

N,3,4,5-tetramethoxy-N-methylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 32
Patents: 255.11067 Da
Monoisotopic Mass: 1.3
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]+	256.11795	153.9
[M+Na]+	278.09989	161.8
[M-H]-	254.10339	159.6
[M+NH4]+	273.14449	171.8
[M+K]+	294.07383	163.4
[M+H-H2O]+	238.10793	147.0
[M+HCOO]-	300.10887	179.3
[M+CH3COO]-	314.12452	201.9
[M+Na-2H]-	276.08534	157.0
[M]+	255.11012	162.5
[M]-	255.11122	162.5

Literature stripe

literature stripe

Patent stripe

patents stripe