CID 6333327

Triphenyl(4-pyridylmethyl)phosphonium chloride

Structural Information

Molecular Formula
C24H21NP
SMILES
C1=CC=C(C=C1)[P+](CC2=CC=NC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H21NP/c1-4-10-22(11-5-1)26(23-12-6-2-7-13-23,24-14-8-3-9-15-24)20-21-16-18-25-19-17-21/h1-19H,20H2/q+1
InChIKey
MEGTYQVCCTVACT-UHFFFAOYSA-N
Compound name
triphenyl(pyridin-4-ylmethyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

129
Patents

354.14117 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.14845 194.0
[M+Na]+ 377.13039 197.5
[M-H]- 353.13389 202.7
[M+NH4]+ 372.17499 203.5
[M+K]+ 393.10433 185.0
[M+H-H2O]+ 337.13843 182.3
[M+HCOO]- 399.13937 218.0
[M+CH3COO]- 413.15502 207.8
[M+Na-2H]- 375.11584 199.1
[M]+ 354.14062 189.7
[M]- 354.14172 189.7
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