CID 3047879

63868-52-0

Structural Information

Molecular Formula
C20H23NO5
SMILES
COC1=CC(=CC(=C1OCC2=CC=CC=C2)OC)C(=O)N3CCOCC3
InChI
InChI=1S/C20H23NO5/c1-23-17-12-16(20(22)21-8-10-25-11-9-21)13-18(24-2)19(17)26-14-15-6-4-3-5-7-15/h3-7,12-13H,8-11,14H2,1-2H3
InChIKey
SOJNZLHAYIICJR-UHFFFAOYSA-N
Compound name
(3,5-dimethoxy-4-phenylmethoxyphenyl)-morpholin-4-ylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

357.15762 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.16490 184.6
[M+Na]+ 380.14684 189.1
[M-H]- 356.15034 192.7
[M+NH4]+ 375.19144 193.8
[M+K]+ 396.12078 187.8
[M+H-H2O]+ 340.15488 173.9
[M+HCOO]- 402.15582 201.8
[M+CH3COO]- 416.17147 213.0
[M+Na-2H]- 378.13229 186.4
[M]+ 357.15707 186.6
[M]- 357.15817 186.6
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

patents stripe