CID 26092

13531-98-1

Structural Information

Molecular Formula
C19H24N2
SMILES
CCC(CCCN(C)C)(C#N)C1=CC=CC2=CC=CC=C21
InChI
InChI=1S/C19H24N2/c1-4-19(15-20,13-8-14-21(2)3)18-12-7-10-16-9-5-6-11-17(16)18/h5-7,9-12H,4,8,13-14H2,1-3H3
InChIKey
IWDPHMLVCKMQDC-UHFFFAOYSA-N
Compound name
5-(dimethylamino)-2-ethyl-2-naphthalen-1-ylpentanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.19394 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.20122 173.2
[M+Na]+ 303.18316 185.1
[M+NH4]+ 298.22776 178.5
[M+K]+ 319.15710 173.7
[M-H]- 279.18666 169.5
[M+Na-2H]- 301.16861 177.2
[M]+ 280.19339 173.3
[M]- 280.19449 173.3
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.