CID 13831

Tributylphosphine

Structural Information

Molecular Formula

C₁₂H₂₇P

SMILES

CCCCP(CCCC)CCCC

InChI

InChI=1S/C12H27P/c1-4-7-10-13(11-8-5-2)12-9-6-3/h4-12H2,1-3H3

InChIKey

TUQOTMZNTHZOKS-UHFFFAOYSA-N

Compound name

tributylphosphane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 191
References: 91307
Patents: 202.18504 Da
Monoisotopic Mass: 3.7
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]+	203.192316	160.0
[M+Na]+	225.174258	164.1
[M-H]-	201.177764	158.0
[M+NH4]+	220.218863	180.0
[M+K]+	241.148198	162.5
[M+H-H2O]+	185.182300	152.3
[M+HCOO]-	247.183241	185.8
[M+CH3COO]-	261.198891	193.5
[M+Na-2H]-	223.159706	158.4
[M]+	202.18449142	164.7
[M]-	202.18558858	164.7

Literature stripe

literature stripe

Patent stripe

patents stripe