CID 3058606

1-naphthalenepentanamide, 2-methoxy-beta-(4-methoxyphenyl)-

Structural Information

Molecular Formula
C23H25NO3
SMILES
COC1=CC=C(C=C1)C(CCC2=C(C=CC3=CC=CC=C32)OC)CC(=O)N
InChI
InChI=1S/C23H25NO3/c1-26-19-11-7-16(8-12-19)18(15-23(24)25)9-13-21-20-6-4-3-5-17(20)10-14-22(21)27-2/h3-8,10-12,14,18H,9,13,15H2,1-2H3,(H2,24,25)
InChIKey
QQTXYOXLBJPMSI-UHFFFAOYSA-N
Compound name
5-(2-methoxynaphthalen-1-yl)-3-(4-methoxyphenyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

363.18344 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 364.190716 189.9
[M+Na]+ 386.172658 194.9
[M-H]- 362.176164 196.2
[M+NH4]+ 381.217263 202.4
[M+K]+ 402.146598 190.5
[M+H-H2O]+ 346.180700 180.4
[M+HCOO]- 408.181641 209.8
[M+CH3COO]- 422.197291 221.5
[M+Na-2H]- 384.158106 191.0
[M]+ 363.18289142 192.4
[M]- 363.18398858 192.4
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.