CID 680295

N-(2-isopropylphenyl)-3,4,5-trimethoxybenzamide

Structural Information

Molecular Formula
C19H23NO4
SMILES
CC(C)C1=CC=CC=C1NC(=O)C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C19H23NO4/c1-12(2)14-8-6-7-9-15(14)20-19(21)13-10-16(22-3)18(24-5)17(11-13)23-4/h6-12H,1-5H3,(H,20,21)
InChIKey
VNKUUKSPNWBREU-UHFFFAOYSA-N
Compound name
3,4,5-trimethoxy-N-(2-propan-2-ylphenyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.16272 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.169996 178.1
[M+Na]+ 352.151938 184.7
[M-H]- 328.155444 185.2
[M+NH4]+ 347.196543 192.0
[M+K]+ 368.125878 182.8
[M+H-H2O]+ 312.159980 169.7
[M+HCOO]- 374.160921 200.8
[M+CH3COO]- 388.176571 215.2
[M+Na-2H]- 350.137386 178.7
[M]+ 329.16217142 183.5
[M]- 329.16326858 183.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.