CID 4590862

34825-99-5

Structural Information

Molecular Formula
C19H14NP
SMILES
C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC=C3C#N
InChI
InChI=1S/C19H14NP/c20-15-16-9-7-8-14-19(16)21(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-14H
InChIKey
FEOUZPAYKDNQBW-UHFFFAOYSA-N
Compound name
2-diphenylphosphanylbenzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

76
Patents

287.0864 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.09368 170.0
[M+Na]+ 310.07562 178.8
[M-H]- 286.07912 175.8
[M+NH4]+ 305.12022 183.3
[M+K]+ 326.04956 170.2
[M+H-H2O]+ 270.08366 152.8
[M+HCOO]- 332.08460 193.4
[M+CH3COO]- 346.10025 179.6
[M+Na-2H]- 308.06107 170.7
[M]+ 287.08585 163.4
[M]- 287.08695 163.4
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