CID 103935

Phosphine oxide, diphenyl((alpha-phenyl-alpha-((2-dimethylamino)ethyl))benzyl)-, hydrochloride

Structural Information

Molecular Formula
C29H30NOP
SMILES
CN(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)P(=O)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C29H30NOP/c1-30(2)24-23-29(25-15-7-3-8-16-25,26-17-9-4-10-18-26)32(31,27-19-11-5-12-20-27)28-21-13-6-14-22-28/h3-22H,23-24H2,1-2H3
InChIKey
OIWJBLNYFRUWMY-UHFFFAOYSA-N
Compound name
3-diphenylphosphoryl-N,N-dimethyl-3,3-diphenylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

439.2065 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 440.21378 212.3
[M+Na]+ 462.19572 213.8
[M-H]- 438.19922 222.8
[M+NH4]+ 457.24032 220.2
[M+K]+ 478.16966 208.0
[M+H-H2O]+ 422.20376 197.8
[M+HCOO]- 484.20470 236.7
[M+CH3COO]- 498.22035 235.5
[M+Na-2H]- 460.18117 213.7
[M]+ 439.20595 211.1
[M]- 439.20705 211.1
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.