CID 3047882

63868-57-5

Structural Information

Molecular Formula
C26H27NO5
SMILES
COC1=C(C=C(C=C1OCC2=CC=CC=C2)C(=O)N3CCOCC3)OCC4=CC=CC=C4
InChI
InChI=1S/C26H27NO5/c1-29-25-23(31-18-20-8-4-2-5-9-20)16-22(26(28)27-12-14-30-15-13-27)17-24(25)32-19-21-10-6-3-7-11-21/h2-11,16-17H,12-15,18-19H2,1H3
InChIKey
SYFZORWSQSMBEA-UHFFFAOYSA-N
Compound name
[4-methoxy-3,5-bis(phenylmethoxy)phenyl]-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

433.18893 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 434.19621 206.4
[M+Na]+ 456.17815 221.5
[M+NH4]+ 451.22275 212.9
[M+K]+ 472.15209 213.1
[M-H]- 432.18165 215.0
[M+Na-2H]- 454.16360 216.0
[M]+ 433.18838 211.1
[M]- 433.18948 211.1
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.