CID 11843552

18583-54-5

Structural Information

Molecular Formula
C25H20Cl2P
SMILES
C1=CC=C(C=C1)[P+](CC2=C(C=CC=C2Cl)Cl)(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H20Cl2P/c26-24-17-10-18-25(27)23(24)19-28(20-11-4-1-5-12-20,21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18H,19H2/q+1
InChIKey
BRUIXKPMICIMTI-UHFFFAOYSA-N
Compound name
(2,6-dichlorophenyl)methyl-triphenylphosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

421.06796 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 422.07524 206.3
[M+Na]+ 444.05718 212.7
[M-H]- 420.06068 215.8
[M+NH4]+ 439.10178 216.7
[M+K]+ 460.03112 198.1
[M+H-H2O]+ 404.06522 196.4
[M+HCOO]- 466.06616 221.8
[M+CH3COO]- 480.08181 217.7
[M+Na-2H]- 442.04263 208.1
[M]+ 421.06741 207.4
[M]- 421.06851 207.4
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