CID 10887135

161583-25-1

Structural Information

Molecular Formula
C36H37NP2
SMILES
C[C@H](C1=CC=CC=C1)N(CCP(C2=CC=CC=C2)C3=CC=CC=C3)CCP(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C36H37NP2/c1-31(32-17-7-2-8-18-32)37(27-29-38(33-19-9-3-10-20-33)34-21-11-4-12-22-34)28-30-39(35-23-13-5-14-24-35)36-25-15-6-16-26-36/h2-26,31H,27-30H2,1H3/t31-/m1/s1
InChIKey
ZVNAHLJBPYKGBV-WJOKGBTCSA-N
Compound name
(1R)-N,N-bis(2-diphenylphosphanylethyl)-1-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

545.2401 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 546.247376 241.7
[M+Na]+ 568.229318 237.7
[M-H]- 544.232824 251.3
[M+NH4]+ 563.273923 243.9
[M+K]+ 584.203258 230.9
[M+H-H2O]+ 528.237360 222.2
[M+HCOO]- 590.238301 267.9
[M+CH3COO]- 604.253951 257.5
[M+Na-2H]- 566.214766 231.5
[M]+ 545.23955142 237.8
[M]- 545.24064858 237.8
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

No patent data available for this compound.