CID 11982345

799297-44-2

Structural Information

Molecular Formula
C21H22NP
SMILES
C[C@H]([C@@H](C1=CC=CC=C1)P(C2=CC=CC=C2)C3=CC=CC=C3)N
InChI
InChI=1S/C21H22NP/c1-17(22)21(18-11-5-2-6-12-18)23(19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17,21H,22H2,1H3/t17-,21+/m1/s1
InChIKey
JWZAIGGNEGTDMG-UTKZUKDTSA-N
Compound name
(1R,2R)-1-diphenylphosphanyl-1-phenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

319.149 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 320.15628 181.2
[M+Na]+ 342.13822 183.3
[M-H]- 318.14172 187.8
[M+NH4]+ 337.18282 193.9
[M+K]+ 358.11216 178.2
[M+H-H2O]+ 302.14626 169.3
[M+HCOO]- 364.14720 206.5
[M+CH3COO]- 378.16285 212.6
[M+Na-2H]- 340.12367 178.9
[M]+ 319.14845 177.2
[M]- 319.14955 177.2
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