CID 202922

Morpholine, 4-(2-((3,4,5-trimethoxybenzyl)oxy)ethyl)-

Structural Information

Molecular Formula
C16H25NO5
SMILES
COC1=CC(=CC(=C1OC)OC)COCCN2CCOCC2
InChI
InChI=1S/C16H25NO5/c1-18-14-10-13(11-15(19-2)16(14)20-3)12-22-9-6-17-4-7-21-8-5-17/h10-11H,4-9,12H2,1-3H3
InChIKey
ASYLAICRHLUBPC-UHFFFAOYSA-N
Compound name
4-[2-[(3,4,5-trimethoxyphenyl)methoxy]ethyl]morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

311.17328 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.18056 173.1
[M+Na]+ 334.16250 178.1
[M-H]- 310.16600 178.1
[M+NH4]+ 329.20710 185.0
[M+K]+ 350.13644 178.1
[M+H-H2O]+ 294.17054 163.8
[M+HCOO]- 356.17148 191.2
[M+CH3COO]- 370.18713 205.5
[M+Na-2H]- 332.14795 175.9
[M]+ 311.17273 178.0
[M]- 311.17383 178.0
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.