CID 202206

7761-67-3

Structural Information

Molecular Formula
C24H29N2O2P
SMILES
CC(CC1=CC=CC=C1)NP(=O)(NC(C)CC2=CC=CC=C2)OC3=CC=CC=C3
InChI
InChI=1S/C24H29N2O2P/c1-20(18-22-12-6-3-7-13-22)25-29(27,28-24-16-10-5-11-17-24)26-21(2)19-23-14-8-4-9-15-23/h3-17,20-21H,18-19H2,1-2H3,(H2,25,26,27)
InChIKey
ZPDRBEUWDRMBBV-UHFFFAOYSA-N
Compound name
N-[phenoxy-(1-phenylpropan-2-ylamino)phosphoryl]-1-phenylpropan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

408.19666 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 409.20394 201.7
[M+Na]+ 431.18588 202.1
[M-H]- 407.18938 208.2
[M+NH4]+ 426.23048 210.4
[M+K]+ 447.15982 197.7
[M+H-H2O]+ 391.19392 188.6
[M+HCOO]- 453.19486 227.5
[M+CH3COO]- 467.21051 230.0
[M+Na-2H]- 429.17133 201.9
[M]+ 408.19611 200.9
[M]- 408.19721 200.9
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.