CID 3058598

75436-91-8

Structural Information

Molecular Formula
C24H25NO3
SMILES
COC1=CC=C(C=C1)C(CCC2=CC=C(C=C2)OC3=CC=CC=C3)CC(=O)N
InChI
InChI=1S/C24H25NO3/c1-27-21-15-11-19(12-16-21)20(17-24(25)26)10-7-18-8-13-23(14-9-18)28-22-5-3-2-4-6-22/h2-6,8-9,11-16,20H,7,10,17H2,1H3,(H2,25,26)
InChIKey
SVYWEMHWAQXEPV-UHFFFAOYSA-N
Compound name
3-(4-methoxyphenyl)-5-(4-phenoxyphenyl)pentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

375.18344 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 376.190716 193.2
[M+Na]+ 398.172658 196.8
[M-H]- 374.176164 201.4
[M+NH4]+ 393.217263 203.4
[M+K]+ 414.146598 192.1
[M+H-H2O]+ 358.180700 182.6
[M+HCOO]- 420.181641 214.4
[M+CH3COO]- 434.197291 221.5
[M+Na-2H]- 396.158106 193.8
[M]+ 375.18289142 194.1
[M]- 375.18398858 194.1
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.