CID 3052187

Brn 2768281

Structural Information

Molecular Formula
C25H21PS2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)SP(=S)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H21PS2/c27-26(23-17-9-3-10-18-23,24-19-11-4-12-20-24)28-25(21-13-5-1-6-14-21)22-15-7-2-8-16-22/h1-20,25H
InChIKey
YEQKPEYSQUEYEB-UHFFFAOYSA-N
Compound name
benzhydrylsulfanyl-diphenyl-sulfanylidene-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

416.08224 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 417.08952 192.5
[M+Na]+ 439.07146 197.7
[M-H]- 415.07496 202.2
[M+NH4]+ 434.11606 202.8
[M+K]+ 455.04540 188.9
[M+H-H2O]+ 399.07950 180.4
[M+HCOO]- 461.08044 209.0
[M+CH3COO]- 475.09609 200.9
[M+Na-2H]- 437.05691 191.3
[M]+ 416.08169 191.2
[M]- 416.08279 191.2
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.