CID 2735897

Cyclopentyltriphenylphosphonium bromide

Structural Information

Molecular Formula
C23H24P
SMILES
C1CCC(C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C23H24P/c1-4-12-20(13-5-1)24(23-18-10-11-19-23,21-14-6-2-7-15-21)22-16-8-3-9-17-22/h1-9,12-17,23H,10-11,18-19H2/q+1
InChIKey
WFYJKYLMVNFRQX-UHFFFAOYSA-N
Compound name
cyclopentyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

389
Patents

331.16156 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.16884 187.1
[M+Na]+ 354.15078 189.3
[M-H]- 330.15428 197.1
[M+NH4]+ 349.19538 200.9
[M+K]+ 370.12472 177.8
[M+H-H2O]+ 314.15882 177.6
[M+HCOO]- 376.15976 211.3
[M+CH3COO]- 390.17541 202.7
[M+Na-2H]- 352.13623 188.2
[M]+ 331.16101 180.6
[M]- 331.16211 180.6
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