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5-Bromo-2-tert-butyl-1,3-dioxan-4-one
SpectraBase Compound ID CHybF78HIrc
InChI InChI=1S/C8H13BrO3/c1-8(2,3)7-11-4-5(9)6(10)12-7/h5,7H,4H2,1-3H3
InChIKey OXXXKIAGEJNPSK-UHFFFAOYSA-N
Mol Weight 237.09 g/mol
Molecular Formula C8H13BrO3
Exact Mass 236.004807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2Xk9SUtBn7s
Name 5-Bromo-2-tert-butyl-1,3-dioxan-4-one
CAS Registry Number 113304-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13BrO3
InChI InChI=1S/C8H13BrO3/c1-8(2,3)7-11-4-5(9)6(10)12-7/h5,7H,4H2,1-3H3
InChIKey OXXXKIAGEJNPSK-UHFFFAOYSA-N
Molecular Weight 237.093 g/mol
SMILES C1(OC(=O)C(Br)CO1)C(C)(C)C
SPLASH splash10-0a4i-9100000000-df5110ad48578edb4851
Synonyms 1,3-Dioxan-4-one, 5-bromo-2-(1,1-dimethylethyl) 5-Bromanyl-2-tert-butyl-1,3-dioxan-4-one
Wiley ID 1477806