CID 116298

64038-95-5

Structural Information

Molecular Formula
C17H25NO5
SMILES
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N2CCOCC2
InChI
InChI=1S/C17H25NO5/c1-4-21-14-11-13(17(19)18-7-9-20-10-8-18)12-15(22-5-2)16(14)23-6-3/h11-12H,4-10H2,1-3H3
InChIKey
QAHVNGBESLDQHG-UHFFFAOYSA-N
Compound name
morpholin-4-yl-(3,4,5-triethoxyphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

323.17328 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 324.180556 176.7
[M+Na]+ 346.162498 181.4
[M-H]- 322.166004 181.8
[M+NH4]+ 341.207103 188.1
[M+K]+ 362.136438 181.2
[M+H-H2O]+ 306.170540 167.6
[M+HCOO]- 368.171481 193.7
[M+CH3COO]- 382.187131 208.0
[M+Na-2H]- 344.147946 177.9
[M]+ 323.17273142 180.7
[M]- 323.17382858 180.7
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.