CID 80102

Tert-butyldiphenylphosphine

Structural Information

Molecular Formula

C₁₆H₁₉P

SMILES

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

InChI

InChI=1S/C16H19P/c1-16(2,3)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,1-3H3

InChIKey

QZUPHAGRBBOLTB-UHFFFAOYSA-N

Compound name

tert-butyl(diphenyl)phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1321
Patents: 242.12244 Da
Monoisotopic Mass: 4.0
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]+	243.129716	161.1
[M+Na]+	265.111658	166.5
[M-H]-	241.115164	166.1
[M+NH4]+	260.156263	178.8
[M+K]+	281.085598	162.9
[M+H-H2O]+	225.119700	151.7
[M+HCOO]-	287.120641	187.2
[M+CH3COO]-	301.136291	195.7
[M+Na-2H]-	263.097106	163.1
[M]+	242.12189142	160.9
[M]-	242.12298858	160.9

Literature stripe

literature stripe

Patent stripe

patents stripe