CID 2733423

Einecs 213-857-2

Structural Information

Molecular Formula
C19H17BrP
SMILES
C1=CC=C(C=C1)[P+](CBr)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H17BrP/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15H,16H2/q+1
InChIKey
FKDAUYUOARWXGL-UHFFFAOYSA-N
Compound name
bromomethyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

299
Patents

355.02512 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 356.03240 193.2
[M+Na]+ 378.01434 201.1
[M-H]- 354.01784 203.2
[M+NH4]+ 373.05894 209.0
[M+K]+ 393.98828 183.4
[M+H-H2O]+ 338.02238 191.6
[M+HCOO]- 400.02332 216.7
[M+CH3COO]- 414.03897 203.2
[M+Na-2H]- 375.99979 198.6
[M]+ 355.02457 209.3
[M]- 355.02567 209.3
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