CID 2172511

N-(4-butylphenyl)-3,5-dimethoxybenzamide

Structural Information

Molecular Formula
C19H23NO3
SMILES
CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=CC(=C2)OC)OC
InChI
InChI=1S/C19H23NO3/c1-4-5-6-14-7-9-16(10-8-14)20-19(21)15-11-17(22-2)13-18(12-15)23-3/h7-13H,4-6H2,1-3H3,(H,20,21)
InChIKey
WUUIVSWBGBAEIA-UHFFFAOYSA-N
Compound name
N-(4-butylphenyl)-3,5-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.1678 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.17508 175.5
[M+Na]+ 336.15702 181.6
[M-H]- 312.16052 182.1
[M+NH4]+ 331.20162 189.9
[M+K]+ 352.13096 178.3
[M+H-H2O]+ 296.16506 166.9
[M+HCOO]- 358.16600 199.0
[M+CH3COO]- 372.18165 210.9
[M+Na-2H]- 334.14247 177.9
[M]+ 313.16725 179.6
[M]- 313.16835 179.6
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.