CID 4342724

(4-ethylphenyl)methyl-triphenylphosphanium

Structural Information

Molecular Formula
C27H26P
SMILES
CCC1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H26P/c1-2-23-18-20-24(21-19-23)22-28(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21H,2,22H2,1H3/q+1
InChIKey
RFRHXYAVBKIHIG-UHFFFAOYSA-N
Compound name
(4-ethylphenyl)methyl-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

381.17722 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 382.18450 196.5
[M+Na]+ 404.16644 216.7
[M+NH4]+ 399.21104 207.6
[M+K]+ 420.14038 204.9
[M-H]- 380.16994 208.5
[M+Na-2H]- 402.15189 212.5
[M]+ 381.17667 203.7
[M]- 381.17777 203.7
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