CID 498169

(2-methoxyethyl)triphenylphosphonium bromide

Structural Information

Molecular Formula
C21H22OP
SMILES
COCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H22OP/c1-22-17-18-23(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16H,17-18H2,1H3/q+1
InChIKey
SUXZPAKTBJBUFX-UHFFFAOYSA-N
Compound name
2-methoxyethyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

61
Patents

321.14084 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 322.14812 177.4
[M+Na]+ 344.13006 195.3
[M+NH4]+ 339.17466 187.9
[M+K]+ 360.10400 185.7
[M-H]- 320.13356 186.4
[M+Na-2H]- 342.11551 191.0
[M]+ 321.14029 183.2
[M]- 321.14139 183.2
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