CID 498823

Nsc635097

Structural Information

Molecular Formula

C₁₆H₂₇P

SMILES

CC(C)(C)CP(CC(C)(C)C)C1=CC=CC=C1

InChI

InChI=1S/C16H27P/c1-15(2,3)12-17(13-16(4,5)6)14-10-8-7-9-11-14/h7-11H,12-13H2,1-6H3

InChIKey

AJCIPAOMINQZQR-UHFFFAOYSA-N

Compound name

bis(2,2-dimethylpropyl)-phenylphosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 250.18504 Da
Monoisotopic Mass: 4.9
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]+	251.19232	168.9
[M+Na]+	273.17426	173.8
[M-H]-	249.17776	170.8
[M+NH4]+	268.21886	187.2
[M+K]+	289.14820	171.3
[M+H-H2O]+	233.18230	161.0
[M+HCOO]-	295.18324	192.1
[M+CH3COO]-	309.19889	199.9
[M+Na-2H]-	271.15971	169.6
[M]+	250.18449	171.2
[M]-	250.18559	171.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe