CID 11561599

(r)-[2-(s-isobutyl-s-phenylsulfoximinoyl)phenyl]diphenylphosphene

Structural Information

Molecular Formula
C28H28NOPS
SMILES
CC(C)CS(=NC1=CC=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3)(=O)C4=CC=CC=C4
InChI
InChI=1S/C28H28NOPS/c1-23(2)22-32(30,26-18-10-5-11-19-26)29-27-20-12-13-21-28(27)31(24-14-6-3-7-15-24)25-16-8-4-9-17-25/h3-21,23H,22H2,1-2H3
InChIKey
OSFUWEWCAFEOJO-UHFFFAOYSA-N
Compound name
[2-[(2-methylpropyl-oxo-phenyl-lambda6-sulfanylidene)amino]phenyl]-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

457.16293 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 458.17021 210.5
[M+Na]+ 480.15215 213.5
[M-H]- 456.15565 221.5
[M+NH4]+ 475.19675 218.7
[M+K]+ 496.12609 206.7
[M+H-H2O]+ 440.16019 196.5
[M+HCOO]- 502.16113 232.0
[M+CH3COO]- 516.17678 236.0
[M+Na-2H]- 478.13760 208.2
[M]+ 457.16238 210.7
[M]- 457.16348 210.7
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.