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]+ 546.24738 241.7
[M+Na]+ 568.22932 237.7
[M-H]- 544.23282 251.3
[M+NH4]+ 563.27392 243.9
[M+K]+ 584.20326 230.9
[M+H-H2O]+ 528.23736 222.2
[M+HCOO]- 590.23830 267.9
[M+CH3COO]- 604.25395 257.5
[M+Na-2H]- 566.21477 231.5
[M]+ 545.23955 237.8
[M]- 545.24065 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.