CID 197824

(chloromethyl)triphenylphosphonium chloride

Structural Information

Molecular Formula
C19H17ClP
SMILES
C1=CC=C(C=C1)[P+](CCl)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H17ClP/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
JRICKEFXPGZPFZ-UHFFFAOYSA-N
Compound name
chloromethyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

708
Patents

311.07565 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 312.08293 172.2
[M+Na]+ 334.06487 191.9
[M+NH4]+ 329.10947 184.0
[M+K]+ 350.03881 181.3
[M-H]- 310.06837 181.8
[M+Na-2H]- 332.05032 186.8
[M]+ 311.07510 178.9
[M]- 311.07620 178.9
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

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