CID 494106

Benzyl(4-methylphenyl)diphenylphosphorane

Structural Information

Molecular Formula
C26H24P
SMILES
CC1=CC=C(C=C1)[P+](CC2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C26H24P/c1-22-17-19-26(20-18-22)27(24-13-7-3-8-14-24,25-15-9-4-10-16-25)21-23-11-5-2-6-12-23/h2-20H,21H2,1H3/q+1
InChIKey
CSTGLINPPDZWSD-UHFFFAOYSA-N
Compound name
benzyl-(4-methylphenyl)-diphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

367.16156 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 368.16884 199.7
[M+Na]+ 390.15078 203.5
[M-H]- 366.15428 209.9
[M+NH4]+ 385.19538 210.4
[M+K]+ 406.12472 190.8
[M+H-H2O]+ 350.15882 188.8
[M+HCOO]- 412.15976 224.5
[M+CH3COO]- 426.17541 212.1
[M+Na-2H]- 388.13623 202.8
[M]+ 367.16101 196.2
[M]- 367.16211 196.2
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