CID 7623

Tributyl phosphite

Structural Information

Molecular Formula

C₁₂H₂₇O₃P

SMILES

CCCCOP(OCCCC)OCCCC

InChI

InChI=1S/C12H27O3P/c1-4-7-10-13-16(14-11-8-5-2)15-12-9-6-3/h4-12H2,1-3H3

InChIKey

XTTGYFREQJCEML-UHFFFAOYSA-N

Compound name

tributyl phosphite

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 1
References: 16485
Patents: 250.16978 Da
Monoisotopic Mass: 3.8
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]+	251.17706	163.1
[M+Na]+	273.15900	170.9
[M+NH4]+	268.20360	169.1
[M+K]+	289.13294	164.9
[M-H]-	249.16250	161.3
[M+Na-2H]-	271.14445	163.9
[M]+	250.16923	163.3
[M]-	250.17033	163.3

Literature stripe

literature stripe

Patent stripe

patents stripe