CID 5017640

Ferrocene, 1,1'-bis(diphenylphosphino)-

Structural Information

Molecular Formula
C17H15P
SMILES
C1C=CC=C1P(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H15P/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16/h1-13H,14H2
InChIKey
RNPZZEPQLKZEQY-UHFFFAOYSA-N
Compound name
cyclopenta-1,3-dien-1-yl(diphenyl)phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

4636
Patents

250.09114 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.09842 159.6
[M+Na]+ 273.08036 165.0
[M-H]- 249.08386 167.6
[M+NH4]+ 268.12496 177.9
[M+K]+ 289.05430 160.4
[M+H-H2O]+ 233.08840 149.2
[M+HCOO]- 295.08934 188.9
[M+CH3COO]- 309.10499 171.7
[M+Na-2H]- 271.06581 159.8
[M]+ 250.09059 158.0
[M]- 250.09169 158.0
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