CID 4683184

Schembl203971

Structural Information

Molecular Formula
C32H34P2
SMILES
C1CCC(CC1)C(CP(C2=CC=CC=C2)C3=CC=CC=C3)P(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C32H34P2/c1-6-16-27(17-7-1)32(34(30-22-12-4-13-23-30)31-24-14-5-15-25-31)26-33(28-18-8-2-9-19-28)29-20-10-3-11-21-29/h2-5,8-15,18-25,27,32H,1,6-7,16-17,26H2
InChIKey
MDAHANCDXSBKPT-UHFFFAOYSA-N
Compound name
(1-cyclohexyl-2-diphenylphosphanylethyl)-diphenylphosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

379
Patents

480.21356 Da
Monoisotopic Mass

8.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 481.22084 223.2
[M+Na]+ 503.20278 219.1
[M-H]- 479.20628 231.5
[M+NH4]+ 498.24738 227.8
[M+K]+ 519.17672 212.0
[M+H-H2O]+ 463.21082 204.8
[M+HCOO]- 525.21176 245.8
[M+CH3COO]- 539.22741 226.5
[M+Na-2H]- 501.18823 212.3
[M]+ 480.21301 213.7
[M]- 480.21411 213.7
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