CID 4657543

1,3-bis(diethylphosphino)propane

Structural Information

Molecular Formula

C₁₁H₂₆P₂

SMILES

CCP(CC)CCCP(CC)CC

InChI

InChI=1S/C11H26P2/c1-5-12(6-2)10-9-11-13(7-3)8-4/h5-11H2,1-4H3

InChIKey

UDQOBFJTYHSIPJ-UHFFFAOYSA-N

Compound name

3-diethylphosphanylpropyl(diethyl)phosphane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 496
Patents: 220.15097 Da
Monoisotopic Mass: 1.5
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]+	221.15825	168.4
[M+Na]+	243.14019	172.4
[M-H]-	219.14369	165.4
[M+NH4]+	238.18479	188.2
[M+K]+	259.11413	171.1
[M+H-H2O]+	203.14823	158.6
[M+HCOO]-	265.14917	198.5
[M+CH3COO]-	279.16482	198.6
[M+Na-2H]-	241.12564	162.6
[M]+	220.15042	173.8
[M]-	220.15152	173.8

Literature stripe

literature stripe

Patent stripe

patents stripe