CID 58555919

1,8-bis(diphenylphosphinyl)naphthalene

Structural Information

Molecular Formula
C34H26O2P2
SMILES
C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)C3=CC=CC4=C3C(=CC=C4)P(=O)(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C34H26O2P2/c35-37(28-17-5-1-6-18-28,29-19-7-2-8-20-29)32-25-13-15-27-16-14-26-33(34(27)32)38(36,30-21-9-3-10-22-30)31-23-11-4-12-24-31/h1-26H
InChIKey
XNKIEKXYLNHGBX-UHFFFAOYSA-N
Compound name
1,8-bis(diphenylphosphoryl)naphthalene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

528.1408 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 529.14808 231.1
[M+Na]+ 551.13002 250.0
[M+NH4]+ 546.17462 239.4
[M+K]+ 567.10396 237.9
[M-H]- 527.13352 242.4
[M+Na-2H]- 549.11547 246.5
[M]+ 528.14025 237.6
[M]- 528.14135 237.6
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