CID 60665

Brn 4517474

Structural Information

Molecular Formula
C15H23NO5
SMILES
CCN(CC)C(=O)COC1=CC(=C(C(=C1)OC)OC)OC
InChI
InChI=1S/C15H23NO5/c1-6-16(7-2)14(17)10-21-11-8-12(18-3)15(20-5)13(9-11)19-4/h8-9H,6-7,10H2,1-5H3
InChIKey
XTPIFUFCKOOJDM-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(3,4,5-trimethoxyphenoxy)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

297.15762 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 298.164896 168.2
[M+Na]+ 320.146838 174.7
[M-H]- 296.150344 173.2
[M+NH4]+ 315.191443 184.3
[M+K]+ 336.120778 175.6
[M+H-H2O]+ 280.154880 160.6
[M+HCOO]- 342.155821 192.5
[M+CH3COO]- 356.171471 210.8
[M+Na-2H]- 318.132286 169.6
[M]+ 297.15707142 177.8
[M]- 297.15816858 177.8
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.