CID 80375

15912-75-1

Structural Information

Molecular Formula

C₂₁H₂₂P

SMILES

CCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22P/c1-2-18-22(19-12-6-3-7-13-19,20-14-8-4-9-15-20)21-16-10-5-11-17-21/h3-17H,2,18H2,1H3/q+1

InChIKey

MSXNDXIAUQJHNS-UHFFFAOYSA-N

Compound name

triphenyl(propyl)phosphanium

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 3285
Patents: 305.1459 Da
Monoisotopic Mass: 4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	306.15318	181.5
[M+Na]+	328.13512	185.8
[M-H]-	304.13862	189.1
[M+NH4]+	323.17972	195.5
[M+K]+	344.10906	174.6
[M+H-H2O]+	288.14316	172.6
[M+HCOO]-	350.14410	207.4
[M+CH3COO]-	364.15975	200.2
[M+Na-2H]-	326.12057	186.2
[M]+	305.14535	179.3
[M]-	305.14645	179.3

Literature stripe

literature stripe

Patent stripe

patents stripe