CID 6335186

4090-60-2

Structural Information

Molecular Formula

C₅H₁₀O₃P

SMILES

CC1(CO[P+](=O)OC1)C

InChI

InChI=1S/C5H10O3P/c1-5(2)3-7-9(6)8-4-5/h3-4H2,1-2H3/q+1

InChIKey

YTWYMHQAVLOJKT-UHFFFAOYSA-N

Compound name

5,5-dimethyl-1,3,2-dioxaphosphinan-2-ium 2-oxide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 377
Patents: 149.03676 Da
Monoisotopic Mass: 0.9
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]+	150.04404	125.8
[M+Na]+	172.02598	139.1
[M+NH4]+	167.07058	136.4
[M+K]+	187.99992	133.8
[M-H]-	148.02948	131.1
[M+Na-2H]-	170.01143	132.2
[M]+	149.03621	129.6
[M]-	149.03731	129.6

Literature stripe

literature stripe

Patent stripe

patents stripe