CID 70500

1005-69-2

Structural Information

Molecular Formula

C₆H₁₃O₃P

SMILES

CC1(COP(OC1)OC)C

InChI

InChI=1S/C6H13O3P/c1-6(2)4-8-10(7-3)9-5-6/h4-5H2,1-3H3

InChIKey

YXFJCUOSUYSZNS-UHFFFAOYSA-N

Compound name

2-methoxy-5,5-dimethyl-1,3,2-dioxaphosphinane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 67
Patents: 164.06023 Da
Monoisotopic Mass: 1.0
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]+	165.06751	133.7
[M+Na]+	187.04945	144.6
[M+NH4]+	182.09405	143.2
[M+K]+	203.02339	138.5
[M-H]-	163.05295	137.4
[M+Na-2H]-	185.03490	138.7
[M]+	164.05968	136.3
[M]-	164.06078	136.3

Literature stripe

literature stripe

Patent stripe

patents stripe