CID 692807

N-(3-chloro-2-methylphenyl)-3,4-dimethoxybenzamide

Structural Information

Molecular Formula
C16H16ClNO3
SMILES
CC1=C(C=CC=C1Cl)NC(=O)C2=CC(=C(C=C2)OC)OC
InChI
InChI=1S/C16H16ClNO3/c1-10-12(17)5-4-6-13(10)18-16(19)11-7-8-14(20-2)15(9-11)21-3/h4-9H,1-3H3,(H,18,19)
InChIKey
RYWSDLDTJGBHBO-UHFFFAOYSA-N
Compound name
N-(3-chloro-2-methylphenyl)-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

305.08188 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 306.08916 167.7
[M+Na]+ 328.07110 176.9
[M-H]- 304.07460 175.1
[M+NH4]+ 323.11570 183.8
[M+K]+ 344.04504 172.6
[M+H-H2O]+ 288.07914 160.8
[M+HCOO]- 350.08008 187.7
[M+CH3COO]- 364.09573 206.8
[M+Na-2H]- 326.05655 170.6
[M]+ 305.08133 173.6
[M]- 305.08243 173.6
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.