CID 10985824

99135-95-2

Structural Information

Molecular Formula
C35H33NP2
SMILES
C1[C@H]([C@@H](CN1CC2=CC=CC=C2)P(C3=CC=CC=C3)C4=CC=CC=C4)P(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C35H33NP2/c1-6-16-29(17-7-1)26-36-27-34(37(30-18-8-2-9-19-30)31-20-10-3-11-21-31)35(28-36)38(32-22-12-4-13-23-32)33-24-14-5-15-25-33/h1-25,34-35H,26-28H2/t34-,35-/m1/s1
InChIKey
GYKMEKRMASHMIH-VSJLXWSYSA-N
Compound name
[(3R,4R)-1-benzyl-4-diphenylphosphanylpyrrolidin-3-yl]-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

483
Patents

529.2088 Da
Monoisotopic Mass

7.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 530.21608 234.4
[M+Na]+ 552.19802 251.2
[M+NH4]+ 547.24262 243.1
[M+K]+ 568.17196 240.4
[M-H]- 528.20152 247.3
[M+Na-2H]- 550.18347 248.6
[M]+ 529.20825 240.7
[M]- 529.20935 240.7
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