CID 120484

(3-(dimethylamino)propyl)diphenylphosphine oxide

Structural Information

Molecular Formula
C17H22NOP
SMILES
CN(C)CCCP(=O)(C1=CC=CC=C1)C2=CC=CC=C2
InChI
InChI=1S/C17H22NOP/c1-18(2)14-9-15-20(19,16-10-5-3-6-11-16)17-12-7-4-8-13-17/h3-8,10-13H,9,14-15H2,1-2H3
InChIKey
NCLIALPDEPSOFD-UHFFFAOYSA-N
Compound name
3-diphenylphosphoryl-N,N-dimethylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

287.1439 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.15118 171.4
[M+Na]+ 310.13312 176.0
[M-H]- 286.13662 177.4
[M+NH4]+ 305.17772 187.4
[M+K]+ 326.10706 172.9
[M+H-H2O]+ 270.14116 160.8
[M+HCOO]- 332.14210 200.0
[M+CH3COO]- 346.15775 207.9
[M+Na-2H]- 308.11857 173.8
[M]+ 287.14335 173.4
[M]- 287.14445 173.4
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