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]+ 350.17508 184.6
[M+Na]+ 372.15702 190.5
[M-H]- 348.16052 191.6
[M+NH4]+ 367.20162 198.1
[M+K]+ 388.13096 186.0
[M+H-H2O]+ 332.16506 175.1
[M+HCOO]- 394.16600 206.6
[M+CH3COO]- 408.18165 217.5
[M+Na-2H]- 370.14247 188.5
[M]+ 349.16725 188.2
[M]- 349.16835 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.