CID 632628

1,4-bis(dicyclohexylphosphonium)butane bis(tetrafluoroborate)

Structural Information

Molecular Formula
C28H52P2
SMILES
C1CCC(CC1)P(CCCCP(C2CCCCC2)C3CCCCC3)C4CCCCC4
InChI
InChI=1S/C28H52P2/c1-5-15-25(16-6-1)29(26-17-7-2-8-18-26)23-13-14-24-30(27-19-9-3-10-20-27)28-21-11-4-12-22-28/h25-28H,1-24H2
InChIKey
WNZGLXFLSFWPMP-UHFFFAOYSA-N
Compound name
dicyclohexyl(4-dicyclohexylphosphanylbutyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

966
Patents

450.35443 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 451.36171 221.2
[M+Na]+ 473.34365 209.6
[M-H]- 449.34715 223.7
[M+NH4]+ 468.38825 227.6
[M+K]+ 489.31759 204.6
[M+H-H2O]+ 433.35169 204.4
[M+HCOO]- 495.35263 233.3
[M+CH3COO]- 509.36828 235.4
[M+Na-2H]- 471.32910 203.2
[M]+ 450.35388 202.6
[M]- 450.35498 202.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe