CID 13329891

145693-67-0

Structural Information

Molecular Formula
C28H27NP2
SMILES
C1[C@@H]([C@H](CN1)P(C2=CC=CC=C2)C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C28H27NP2/c1-5-13-23(14-6-1)30(24-15-7-2-8-16-24)27-21-29-22-28(27)31(25-17-9-3-10-18-25)26-19-11-4-12-20-26/h1-20,27-29H,21-22H2/t27-,28-/m0/s1
InChIKey
YMRKZKDKJJCIHH-NSOVKSMOSA-N
Compound name
[(3S,4S)-4-diphenylphosphanylpyrrolidin-3-yl]-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

439.16187 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.16915 210.7
[M+Na]+ 462.15109 225.5
[M+NH4]+ 457.19569 219.4
[M+K]+ 478.12503 216.7
[M-H]- 438.15459 220.8
[M+Na-2H]- 460.13654 223.0
[M]+ 439.16132 215.8
[M]- 439.16242 215.8
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