CID 57356037

(9-benzyl-9-fluorenyl)dicyclohexylphosphonium tetrafluoroborate

Structural Information

Molecular Formula
C32H37P
SMILES
C1CCC(CC1)P(C2CCCCC2)C3(C4=CC=CC=C4C5=CC=CC=C53)CC6=CC=CC=C6
InChI
InChI=1S/C32H37P/c1-4-14-25(15-5-1)24-32(30-22-12-10-20-28(30)29-21-11-13-23-31(29)32)33(26-16-6-2-7-17-26)27-18-8-3-9-19-27/h1,4-5,10-15,20-23,26-27H,2-3,6-9,16-19,24H2
InChIKey
RJNKJOHSGMPLDI-UHFFFAOYSA-N
Compound name
(9-benzylfluoren-9-yl)-dicyclohexylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

452.26328 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 453.27056 217.0
[M+Na]+ 475.25250 215.9
[M-H]- 451.25600 226.1
[M+NH4]+ 470.29710 229.2
[M+K]+ 491.22644 207.4
[M+H-H2O]+ 435.26054 201.5
[M+HCOO]- 497.26148 232.2
[M+CH3COO]- 511.27713 221.7
[M+Na-2H]- 473.23795 208.8
[M]+ 452.26273 206.0
[M]- 452.26383 206.0
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

patents stripe