CID 3056488

73790-49-5

Structural Information

Molecular Formula
C40H38P2
SMILES
C1=CC=C(C=C1)[P+](CCCC[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C40H38P2/c1-7-21-35(22-8-1)41(36-23-9-2-10-24-36,37-25-11-3-12-26-37)33-19-20-34-42(38-27-13-4-14-28-38,39-29-15-5-16-30-39)40-31-17-6-18-32-40/h1-18,21-32H,19-20,33-34H2/q+2
InChIKey
NEHOZOUEOAZNQN-UHFFFAOYSA-N
Compound name
triphenyl(4-triphenylphosphaniumylbutyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

282
Patents

580.2449 Da
Monoisotopic Mass

9.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 581.25218 247.0
[M+Na]+ 603.23412 268.7
[M+NH4]+ 598.27872 257.5
[M+K]+ 619.20806 255.5
[M-H]- 579.23762 263.3
[M+Na-2H]- 601.21957 265.7
[M]+ 580.24435 256.1
[M]- 580.24545 256.1
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

patents stripe