CID 138131

Allyldiphenylphosphine oxide

Structural Information

Molecular Formula
C15H15OP
SMILES
C=CCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C15H15OP/c1-2-13-17(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h2-12H,1,13H2
InChIKey
PGPAPANRSWMTQO-UHFFFAOYSA-N
Compound name
[phenyl(prop-2-enyl)phosphoryl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

151
Patents

242.08606 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.09334 157.4
[M+Na]+ 265.07528 164.0
[M-H]- 241.07878 162.5
[M+NH4]+ 260.11988 174.9
[M+K]+ 281.04922 159.4
[M+H-H2O]+ 225.08332 147.9
[M+HCOO]- 287.08426 185.4
[M+CH3COO]- 301.09991 192.8
[M+Na-2H]- 263.06073 161.2
[M]+ 242.08551 157.5
[M]- 242.08661 157.5
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