CID 106066

67905-64-0

Structural Information

Molecular Formula
C15H21N3O2
SMILES
CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OCC
InChI
InChI=1S/C15H21N3O2/c1-4-18(10-6-9-16)14-11-13(17-12(3)19)7-8-15(14)20-5-2/h7-8,11H,4-6,10H2,1-3H3,(H,17,19)
InChIKey
JDOMEWCDWXXVNR-UHFFFAOYSA-N
Compound name
N-[3-[2-cyanoethyl(ethyl)amino]-4-ethoxyphenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.1634 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.17068 167.3
[M+Na]+ 298.15262 176.5
[M+NH4]+ 293.19722 170.3
[M+K]+ 314.12656 167.6
[M-H]- 274.15612 162.1
[M+Na-2H]- 296.13807 169.2
[M]+ 275.16285 166.0
[M]- 275.16395 166.0
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.