CID 26081

Ethylamine, n,n-diethyl-2-((3,4,5-trimethoxybenzyl)oxy)-

Structural Information

Molecular Formula
C16H27NO4
SMILES
CCN(CC)CCOCC1=CC(=C(C(=C1)OC)OC)OC
InChI
InChI=1S/C16H27NO4/c1-6-17(7-2)8-9-21-12-13-10-14(18-3)16(20-5)15(11-13)19-4/h10-11H,6-9,12H2,1-5H3
InChIKey
CECJCPKULNJGML-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-[(3,4,5-trimethoxyphenyl)methoxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.194 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.201276 171.4
[M+Na]+ 320.183218 177.6
[M-H]- 296.186724 176.1
[M+NH4]+ 315.227823 187.7
[M+K]+ 336.157158 177.6
[M+H-H2O]+ 280.191260 163.7
[M+HCOO]- 342.192201 196.0
[M+CH3COO]- 356.207851 212.3
[M+Na-2H]- 318.168666 173.4
[M]+ 297.19345142 181.3
[M]- 297.19454858 181.3
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.