CID 2189414

63504-26-7

Structural Information

Molecular Formula
C19H22N4
SMILES
CCCCN(CCCC)C1=CC=C(C=C1)C(=C(C#N)C#N)C#N
InChI
InChI=1S/C19H22N4/c1-3-5-11-23(12-6-4-2)18-9-7-16(8-10-18)19(15-22)17(13-20)14-21/h7-10H,3-6,11-12H2,1-2H3
InChIKey
NBYCHAQZDVGBCZ-UHFFFAOYSA-N
Compound name
2-[4-(dibutylamino)phenyl]ethene-1,1,2-tricarbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

47
Patents

306.18445 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.19173 209.7
[M+Na]+ 329.17367 213.7
[M+NH4]+ 324.21827 207.7
[M+K]+ 345.14761 204.0
[M-H]- 305.17717 200.6
[M+Na-2H]- 327.15912 205.2
[M]+ 306.18390 206.5
[M]- 306.18500 206.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe