CID 498136

Phosphorane, butylidenetriphenyl-

Structural Information

Molecular Formula
C22H23P
SMILES
CCCC=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C22H23P/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22/h4-19H,2-3H2,1H3
InChIKey
RIGUTONFWSZQSU-UHFFFAOYSA-N
Compound name
butylidene(triphenyl)-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

69
Patents

318.15375 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.16103 181.8
[M+Na]+ 341.14297 186.2
[M-H]- 317.14647 188.9
[M+NH4]+ 336.18757 195.6
[M+K]+ 357.11691 179.5
[M+H-H2O]+ 301.15101 170.0
[M+HCOO]- 363.15195 207.9
[M+CH3COO]- 377.16760 208.0
[M+Na-2H]- 339.12842 183.7
[M]+ 318.15320 180.2
[M]- 318.15430 180.2
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