CID 498098

15935-94-1

Structural Information

Molecular Formula
C21H19P
SMILES
C=CC=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C21H19P/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/h2-18H,1H2
InChIKey
KTXDDSBSRMDZLM-UHFFFAOYSA-N
Compound name
triphenyl(prop-2-enylidene)-lambda5-phosphane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

302.12244 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.12972 175.8
[M+Na]+ 325.11166 181.0
[M-H]- 301.11516 183.2
[M+NH4]+ 320.15626 190.2
[M+K]+ 341.08560 173.9
[M+H-H2O]+ 285.11970 164.4
[M+HCOO]- 347.12064 202.5
[M+CH3COO]- 361.13629 204.2
[M+Na-2H]- 323.09711 178.3
[M]+ 302.12189 173.3
[M]- 302.12299 173.3
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