CID 209359

19779-55-6

Structural Information

Molecular Formula
C15H19NO6
SMILES
COC1=C(C=CC(=C1)C(=O)COC(=O)CN2CCOCC2)O
InChI
InChI=1S/C15H19NO6/c1-20-14-8-11(2-3-12(14)17)13(18)10-22-15(19)9-16-4-6-21-7-5-16/h2-3,8,17H,4-7,9-10H2,1H3
InChIKey
VLZUHNAJSYDBKG-UHFFFAOYSA-N
Compound name
[2-(4-hydroxy-3-methoxyphenyl)-2-oxoethyl] 2-morpholin-4-ylacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.12125 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.128526 169.1
[M+Na]+ 332.110468 173.2
[M-H]- 308.113974 172.8
[M+NH4]+ 327.155073 179.7
[M+K]+ 348.084408 173.1
[M+H-H2O]+ 292.118510 160.4
[M+HCOO]- 354.119451 184.7
[M+CH3COO]- 368.135101 200.9
[M+Na-2H]- 330.095916 170.6
[M]+ 309.12070142 170.3
[M]- 309.12179858 170.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.