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4-Methyl-2,6,7-trioxa-1-phosphabicyclo-[2.2.2]-octane-1-oxide
SpectraBase Compound ID FlM1ElSjDdt
InChI InChI=1S/C5H9O4P/c1-5-2-7-10(6,8-3-5)9-4-5/h2-4H2,1H3
InChIKey SEOXVQTUPVKLTH-UHFFFAOYSA-N
Mol Weight 164.1 g/mol
Molecular Formula C5H9O4P
Exact Mass 164.023846 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKcXptqLuhi
Name 1,3-Propanediol, 2-(hydroxymethyl)-2-methyl-, cyclic phosphate
CAS Registry Number 1449-89-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C5H9O4P
InChI InChI=1S/C5H9O4P/c1-5-2-7-10(6,8-3-5)9-4-5/h2-4H2,1H3
InChIKey SEOXVQTUPVKLTH-UHFFFAOYSA-N
Molecular Weight 164.097 g/mol
SMILES C1OP2(OCC1(CO2)C)=O
SPLASH splash10-000i-9300000000-acbfd18eb76b4c344a00
Source of Spectrum W5-1989-32596-1
Synonyms 1,3-Propanediol, 2-(hydroxymethyl)-2-methyl-, cyclic phosphate (1:1) 4-Isopropyl-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane-1-oxide 4-Methyl-1-oxo-1-phospha-2,6,7-trioxabicyclo(2.2.2)octane 4-Methyl-2,6,7-trioxa-1-phosphabicyclo[2.2.2]octane-1-oxide Methyl bicyclophosphate BRN 1909770
Wiley ID 1159766