CID 720865

4-(3,4-dimethoxyphenyl)-n-(2-naphthyl)butanamide

Structural Information

Molecular Formula
C22H23NO3
SMILES
COC1=C(C=C(C=C1)CCCC(=O)NC2=CC3=CC=CC=C3C=C2)OC
InChI
InChI=1S/C22H23NO3/c1-25-20-13-10-16(14-21(20)26-2)6-5-9-22(24)23-19-12-11-17-7-3-4-8-18(17)15-19/h3-4,7-8,10-15H,5-6,9H2,1-2H3,(H,23,24)
InChIKey
RFHOXTWWHVRIKG-UHFFFAOYSA-N
Compound name
4-(3,4-dimethoxyphenyl)-N-naphthalen-2-ylbutanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.1678 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.175076 184.6
[M+Na]+ 372.157018 190.5
[M-H]- 348.160524 191.6
[M+NH4]+ 367.201623 198.1
[M+K]+ 388.130958 186.0
[M+H-H2O]+ 332.165060 175.1
[M+HCOO]- 394.166001 206.6
[M+CH3COO]- 408.181651 217.5
[M+Na-2H]- 370.142466 188.5
[M]+ 349.16725142 188.2
[M]- 349.16834858 188.2
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.