CID 37076

35158-65-7

Structural Information

Molecular Formula
C15H23NO4
SMILES
CCN(CC)CCOC(=O)COC1=CC=CC(=C1)OC
InChI
InChI=1S/C15H23NO4/c1-4-16(5-2)9-10-19-15(17)12-20-14-8-6-7-13(11-14)18-3/h6-8,11H,4-5,9-10,12H2,1-3H3
InChIKey
FIMUUXBVCFKKRK-UHFFFAOYSA-N
Compound name
2-(diethylamino)ethyl 2-(3-methoxyphenoxy)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

281.16272 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 282.169996 167.0
[M+Na]+ 304.151938 171.8
[M-H]- 280.155444 171.3
[M+NH4]+ 299.196543 183.2
[M+K]+ 320.125878 171.9
[M+H-H2O]+ 264.159980 159.1
[M+HCOO]- 326.160921 191.2
[M+CH3COO]- 340.176571 206.3
[M+Na-2H]- 302.137386 169.6
[M]+ 281.16217142 174.3
[M]- 281.16326858 174.3
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.