CID 3056177

1,3,4-oxadiazol-2(3h)-one, 5-(4-ethoxy-3,5-dimethoxyphenyl)-3-(4-morpholinylmethyl)-

Structural Information

Molecular Formula
C17H23N3O6
SMILES
CCOC1=C(C=C(C=C1OC)C2=NN(C(=O)O2)CN3CCOCC3)OC
InChI
InChI=1S/C17H23N3O6/c1-4-25-15-13(22-2)9-12(10-14(15)23-3)16-18-20(17(21)26-16)11-19-5-7-24-8-6-19/h9-10H,4-8,11H2,1-3H3
InChIKey
JGFSEVFDPNZCTI-UHFFFAOYSA-N
Compound name
5-(4-ethoxy-3,5-dimethoxyphenyl)-3-(morpholin-4-ylmethyl)-1,3,4-oxadiazol-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.1587 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.16598 184.9
[M+Na]+ 388.14792 197.4
[M+NH4]+ 383.19252 189.1
[M+K]+ 404.12186 195.1
[M-H]- 364.15142 189.4
[M+Na-2H]- 386.13337 188.8
[M]+ 365.15815 187.7
[M]- 365.15925 187.7
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.