CID 3083896

(hydroxymethyl)triphenylphosphonium chloride

Structural Information

Molecular Formula
C19H18OP
SMILES
C1=CC=C(C=C1)[P+](CO)(C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H18OP/c20-16-21(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2/q+1
InChIKey
PHTYUJZVAWPHRZ-UHFFFAOYSA-N
Compound name
hydroxymethyl(triphenyl)phosphanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

252
Patents

293.10953 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.11681 175.5
[M+Na]+ 316.09875 180.1
[M-H]- 292.10225 182.2
[M+NH4]+ 311.14335 189.2
[M+K]+ 332.07269 169.1
[M+H-H2O]+ 276.10679 167.2
[M+HCOO]- 338.10773 200.8
[M+CH3COO]- 352.12338 193.5
[M+Na-2H]- 314.08420 181.1
[M]+ 293.10898 172.2
[M]- 293.11008 172.2
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