CID 655104

Acetamide, n-(3-(dimethylamino)propyl)-2-((2-ethyl-6-methyl-3-pyridinyl)oxy)-, ethanedioate (1:2)

Structural Information

Molecular Formula
C15H25N3O2
SMILES
CCC1=C(C=CC(=N1)C)OCC(=O)NCCCN(C)C
InChI
InChI=1S/C15H25N3O2/c1-5-13-14(8-7-12(2)17-13)20-11-15(19)16-9-6-10-18(3)4/h7-8H,5-6,9-11H2,1-4H3,(H,16,19)
InChIKey
XICCHOGVPNYPFH-UHFFFAOYSA-N
Compound name
N-[3-(dimethylamino)propyl]-2-(2-ethyl-6-methylpyridin-3-yl)oxyacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

279.19467 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.20195 169.2
[M+Na]+ 302.18389 174.3
[M-H]- 278.18739 172.4
[M+NH4]+ 297.22849 184.3
[M+K]+ 318.15783 173.1
[M+H-H2O]+ 262.19193 160.7
[M+HCOO]- 324.19287 192.7
[M+CH3COO]- 338.20852 211.0
[M+Na-2H]- 300.16934 171.5
[M]+ 279.19412 173.8
[M]- 279.19522 173.8
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.