CID 2724570

Einecs 225-301-6

Structural Information

Molecular Formula
C24H28P
SMILES
CCCCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C24H28P/c1-2-3-4-14-21-25(22-15-8-5-9-16-22,23-17-10-6-11-18-23)24-19-12-7-13-20-24/h5-13,15-20H,2-4,14,21H2,1H3/q+1
InChIKey
CBPVAIUOSQZRCK-UHFFFAOYSA-N
Compound name
hexyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

391
Patents

347.19287 Da
Monoisotopic Mass

7.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 348.20015 196.0
[M+Na]+ 370.18209 198.9
[M-H]- 346.18559 202.9
[M+NH4]+ 365.22669 208.2
[M+K]+ 386.15603 186.9
[M+H-H2O]+ 330.19013 186.3
[M+HCOO]- 392.19107 220.7
[M+CH3COO]- 406.20672 209.0
[M+Na-2H]- 368.16754 198.9
[M]+ 347.19232 194.7
[M]- 347.19342 194.7
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