CID 99398

Phosphine oxide, cyclohexyldihexyl-

Structural Information

Molecular Formula
C18H37OP
SMILES
CCCCCCP(=O)(CCCCCC)C1CCCCC1
InChI
InChI=1S/C18H37OP/c1-3-5-7-12-16-20(19,17-13-8-6-4-2)18-14-10-9-11-15-18/h18H,3-17H2,1-2H3
InChIKey
SXNHVRVUGYTRGR-UHFFFAOYSA-N
Compound name
dihexylphosphorylcyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

300.2582 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 301.26548 185.3
[M+Na]+ 323.24742 186.0
[M-H]- 299.25092 184.9
[M+NH4]+ 318.29202 200.8
[M+K]+ 339.22136 182.5
[M+H-H2O]+ 283.25546 176.0
[M+HCOO]- 345.25640 206.3
[M+CH3COO]- 359.27205 208.4
[M+Na-2H]- 321.23287 182.2
[M]+ 300.25765 186.0
[M]- 300.25875 186.0
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.