CID 1189097

N-(4-chloro-2-methoxy-5-methylphenyl)-3,4,5-trimethoxybenzamide

Structural Information

Molecular Formula
C18H20ClNO5
SMILES
CC1=CC(=C(C=C1Cl)OC)NC(=O)C2=CC(=C(C(=C2)OC)OC)OC
InChI
InChI=1S/C18H20ClNO5/c1-10-6-13(14(22-2)9-12(10)19)20-18(21)11-7-15(23-3)17(25-5)16(8-11)24-4/h6-9H,1-5H3,(H,20,21)
InChIKey
WHACQWUBBSTKAG-UHFFFAOYSA-N
Compound name
N-(4-chloro-2-methoxy-5-methylphenyl)-3,4,5-trimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.103 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.11028 181.5
[M+Na]+ 388.09222 191.2
[M-H]- 364.09572 189.3
[M+NH4]+ 383.13682 195.5
[M+K]+ 404.06616 188.1
[M+H-H2O]+ 348.10026 174.2
[M+HCOO]- 410.10120 201.2
[M+CH3COO]- 424.11685 219.7
[M+Na-2H]- 386.07767 182.2
[M]+ 365.10245 191.7
[M]- 365.10355 191.7
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.