CID 1268120

2,3-diphenylacrylonitrile

Structural Information

Molecular Formula
C15H11N
SMILES
C1=CC=C(C=C1)/C=C(/C#N)\C2=CC=CC=C2
InChI
InChI=1S/C15H11N/c16-12-15(14-9-5-2-6-10-14)11-13-7-3-1-4-8-13/h1-11H/b15-11-
InChIKey
VFOKYTYWXOYPOX-PTNGSMBKSA-N
Compound name
(E)-2,3-diphenylprop-2-enenitrile
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

14
References

2753
Patents

205.08914 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.09642 152.2
[M+Na]+ 228.07836 161.4
[M-H]- 204.08186 157.2
[M+NH4]+ 223.12296 168.7
[M+K]+ 244.05230 154.6
[M+H-H2O]+ 188.08640 138.6
[M+HCOO]- 250.08734 171.7
[M+CH3COO]- 264.10299 163.1
[M+Na-2H]- 226.06381 157.5
[M]+ 205.08859 145.1
[M]- 205.08969 145.1
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

No patent data available for this compound.