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4H-1,3-Dioxin-4-one, 5-bromo-2-(1,1-dimethylethyl)-6-methyl-, (R)-
SpectraBase Compound ID 2bpINorqxOj
InChI InChI=1S/C9H13BrO3/c1-5-6(10)7(11)13-8(12-5)9(2,3)4/h8H,1-4H3/t8-/m1/s1
InChIKey DENJNIORZTYWBO-MRVPVSSYSA-N
Mol Weight 249.1 g/mol
Molecular Formula C9H13BrO3
Exact Mass 248.004807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CGGJtR6f27
Name 4H-1,3-Dioxin-4-one, 5-bromo-2-(1,1-dimethylethyl)-6-methyl-, (R)-
Alternate Name(s) (2R)-5-bromo-2-(tert-butyl)-6-methyl-2H,4H-1,3-dioxine-4-one (2R)-5-bromo-2-tert-butyl-6-methyl-4H-1,3-dioxin-4-one
CAS Registry Number 113304-22-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13BrO3
InChI InChI=1S/C9H13BrO3/c1-5-6(10)7(11)13-8(12-5)9(2,3)4/h8H,1-4H3/t8-/m1/s1
InChIKey DENJNIORZTYWBO-MRVPVSSYSA-N
Molecular Weight 249.104 g/mol
SMILES C=1(C(O[C@@](OC1C)(C(C)(C)C)[H])=O)Br
SPLASH splash10-08fu-8910000000-814e4ff68611f0e18f18
Source of Spectrum H-70-1111-14
Wiley ID 1250439