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(2R,6R)-2-(4-Bromo-phenyl)-6-methyl-tetrahydro-pyran-4-one
SpectraBase Compound ID Iw4dsPdmElE
InChI InChI=1S/C12H13BrO2/c1-8-6-11(14)7-12(15-8)9-2-4-10(13)5-3-9/h2-5,8,12H,6-7H2,1H3/t8-,12-/m1/s1
InChIKey ADEFQWYRILBIGU-PRHODGIISA-N
Mol Weight 269.14 g/mol
Molecular Formula C12H13BrO2
Exact Mass 268.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIQuWgOd2Ds
Name (2R,6R)-2-(4-Bromo-phenyl)-6-methyl-tetrahydro-pyran-4-one
Alternate Name(s) 2-(4-Bromophenyl)-tetrahydro-6-methylpyran-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13BrO2
InChI InChI=1S/C12H13BrO2/c1-8-6-11(14)7-12(15-8)9-2-4-10(13)5-3-9/h2-5,8,12H,6-7H2,1H3/t8-,12-/m1/s1
InChIKey ADEFQWYRILBIGU-PRHODGIISA-N
Molecular Weight 269.138 g/mol
SMILES [C@@]1(O[C@@](CC(C1)=O)(C)[H])(c1ccc(cc1)Br)[H]
SPLASH splash10-001r-0920000000-fa1bd97f0bd17275467f
Source of Spectrum F-68-3919-25
Wiley ID 1708599