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4,4,6-Trimethyl-5-bromopyran-2-one
SpectraBase Compound ID 1vn4HHOpEDH
InChI InChI=1S/C8H13BrO2/c1-5-7(9)8(2,3)4-6(10)11-5/h5,7H,4H2,1-3H3
InChIKey SAZKITWVKKECSQ-UHFFFAOYSA-N
Mol Weight 221.09 g/mol
Molecular Formula C8H13BrO2
Exact Mass 220.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HyonoUMzsG4
Name 4,4,6-Trimethyl-5-bromopyran-2-one
Alternate Name(s) 4,4,6-Trimethyl-5-bromo-tetrahydropyran-2-one 5-Bromo-4,4,6-trimethyl-2-oxanone 5-Bromo-4,4,6-trimethyloxan-2-one 5-Bromanyl-4,4,6-trimethyl-oxan-2-one
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Formula C8H13BrO2
InChI InChI=1S/C8H13BrO2/c1-5-7(9)8(2,3)4-6(10)11-5/h5,7H,4H2,1-3H3
InChIKey SAZKITWVKKECSQ-UHFFFAOYSA-N
Molecular Weight 221.094 g/mol
SMILES C1(C(C(C)OC(C1)=O)Br)(C)C
SPLASH splash10-053e-9500000000-9288e9f1bbbfc235a287
Source of Spectrum QA-31-167-2
Wiley ID 860914