CID 140127

16721-45-2

Structural Information

Molecular Formula

C₂₅H₂₁P

SMILES

C1=CC=C(C=C1)C=P(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21P/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25/h1-21H

InChIKey

BHOMJBFLUFSZLW-UHFFFAOYSA-N

Compound name

benzylidene(triphenyl)-lambda5-phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 138
Patents: 352.1381 Da
Monoisotopic Mass: 5.4
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]+	353.14538	189.4
[M+Na]+	375.12732	193.6
[M-H]-	351.13082	199.2
[M+NH4]+	370.17192	200.8
[M+K]+	391.10126	185.7
[M+H-H2O]+	335.13536	176.2
[M+HCOO]-	397.13630	215.2
[M+CH3COO]-	411.15195	198.5
[M+Na-2H]-	373.11277	191.6
[M]+	352.13755	185.5
[M]-	352.13865	185.5

Literature stripe

literature stripe

Patent stripe

patents stripe