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4-Bromo-2-(5,5-dimethyl-1,3-dioxan-2-yl)-6-methoxyphenol
SpectraBase Compound ID 2t22fKmsea6
InChI InChI=1S/C13H17BrO4/c1-13(2)6-17-12(18-7-13)9-4-8(14)5-10(16-3)11(9)15/h4-5,12,15H,6-7H2,1-3H3
InChIKey MRXPPZNQVYAKHM-UHFFFAOYSA-N
Mol Weight 317.18 g/mol
Molecular Formula C13H17BrO4
Exact Mass 316.031022 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JmK4iak0eXP
Name 4-Bromo-2-(5,5-dimethyl-1,3-dioxan-2-yl)-6-methoxyphenol
Appearance Pale yellow solid
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Exact Mass 316.031022023 u
Formula C13H17BrO4
InChI InChI=1S/C13H17BrO4/c1-13(2)6-17-12(18-7-13)9-4-8(14)5-10(16-3)11(9)15/h4-5,12,15H,6-7H2,1-3H3
InChIKey MRXPPZNQVYAKHM-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201800806
Molecular Weight 317.179 g/mol
Reported Formula C13H17BrO4
SMILES OC1=C(C=C(Br)C=C1OC)C1OCC(CO1)(C)C
SPLASH splash10-001i-0192000000-460c4c601e0f895c7ce2
Source of Spectrum K1-2018-4692-7 (DOI: 10.1002/ejoc.201800806)
Wiley ID 1894269