CID 85421

48234-64-6

Structural Information

Molecular Formula
C37H30P
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C37H30P/c1-7-19-31(20-8-1)37(32-21-9-2-10-22-32,33-23-11-3-12-24-33)38(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36/h1-30H/q+1
InChIKey
CYUKLJGLQGQRCJ-UHFFFAOYSA-N
Compound name
triphenyl(trityl)phosphanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

121
Patents

505.20853 Da
Monoisotopic Mass

9.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 506.21581 237.6
[M+Na]+ 528.19775 237.4
[M-H]- 504.20125 250.8
[M+NH4]+ 523.24235 240.1
[M+K]+ 544.17169 223.1
[M+H-H2O]+ 488.20579 222.6
[M+HCOO]- 550.20673 257.2
[M+CH3COO]- 564.22238 235.4
[M+Na-2H]- 526.18320 239.8
[M]+ 505.20798 229.7
[M]- 505.20908 229.7
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