CID 2724215

Einecs 218-242-2

Structural Information

Molecular Formula
C21H18P
SMILES
C#CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H18P/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h1,3-17H,18H2/q+1
InChIKey
GNEAAXYJEIDVFX-UHFFFAOYSA-N
Compound name
triphenyl(prop-2-ynyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

362
Patents

301.11462 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.12190 184.0
[M+Na]+ 324.10384 192.1
[M-H]- 300.10734 188.6
[M+NH4]+ 319.14844 196.2
[M+K]+ 340.07778 177.4
[M+H-H2O]+ 284.11188 169.6
[M+HCOO]- 346.11282 203.6
[M+CH3COO]- 360.12847 204.8
[M+Na-2H]- 322.08929 186.9
[M]+ 301.11407 175.7
[M]- 301.11517 175.7
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