CID 6104258

Benzyl(2-butenyl)diphenylphosphorane

Structural Information

Molecular Formula
C23H24P
SMILES
C/C=C/C[P+](CC1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H24P/c1-2-3-19-24(22-15-9-5-10-16-22,23-17-11-6-12-18-23)20-21-13-7-4-8-14-21/h2-18H,19-20H2,1H3/q+1/b3-2+
InChIKey
BHTORTGZPSXZFT-NSCUHMNNSA-N
Compound name
benzyl-[(E)-but-2-enyl]-diphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.16156 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.16884 182.4
[M+Na]+ 354.15078 200.4
[M+NH4]+ 349.19538 192.9
[M+K]+ 370.12472 189.8
[M-H]- 330.15428 191.5
[M+Na-2H]- 352.13623 195.8
[M]+ 331.16101 188.3
[M]- 331.16211 188.3
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.