CID 17393

Brn 2125542

Structural Information

Molecular Formula
C17H20N2
SMILES
CCN(C)CCC(C#N)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C17H20N2/c1-3-19(2)12-11-15(13-18)17-10-6-8-14-7-4-5-9-16(14)17/h4-10,15H,3,11-12H2,1-2H3
InChIKey
JSOQENUVEIVNAX-UHFFFAOYSA-N
Compound name
4-[ethyl(methyl)amino]-2-naphthalen-1-ylbutanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

252.16264 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 253.16992 164.7
[M+Na]+ 275.15186 177.0
[M+NH4]+ 270.19646 170.4
[M+K]+ 291.12580 165.5
[M-H]- 251.15536 161.4
[M+Na-2H]- 273.13731 168.9
[M]+ 252.16209 164.8
[M]- 252.16319 164.8
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.