CID 88059

19433-94-4

Structural Information

Molecular Formula
C14H19N3O2
SMILES
CCN(CCC#N)C1=C(C=CC(=C1)NC(=O)C)OC
InChI
InChI=1S/C14H19N3O2/c1-4-17(9-5-8-15)13-10-12(16-11(2)18)6-7-14(13)19-3/h6-7,10H,4-5,9H2,1-3H3,(H,16,18)
InChIKey
GMJYHCWSTTTWRT-UHFFFAOYSA-N
Compound name
N-[3-[2-cyanoethyl(ethyl)amino]-4-methoxyphenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

17
Patents

261.14774 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.15502 163.3
[M+Na]+ 284.13696 172.6
[M+NH4]+ 279.18156 166.5
[M+K]+ 300.11090 164.0
[M-H]- 260.14046 158.2
[M+Na-2H]- 282.12241 165.5
[M]+ 261.14719 162.1
[M]- 261.14829 162.1
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

patents stripe