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2-Cyclohexen-1-one, 3-bromo-4-hydroxy-2,6,6-trimethyl-, (R)-
SpectraBase Compound ID QljlT7HkVM
InChI InChI=1S/C9H13BrO2/c1-5-7(10)6(11)4-9(2,3)8(5)12/h6,11H,4H2,1-3H3/t6-/m1/s1
InChIKey DSGUMCWHIDMEQS-ZCFIWIBFSA-N
Mol Weight 233.1 g/mol
Molecular Formula C9H13BrO2
Exact Mass 232.009893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1PcpXLzMQOO
Name 2-Cyclohexen-1-one, 3-bromo-4-hydroxy-2,6,6-trimethyl-, (R)-
Alternate Name(s) (4R)-3-bromo-4-hydroxy-2,6,6-trimethyl-2-cyclohexen-1-one (R)-3-bromo-4-hydroxy-2,6,6-trimethyl-2-cyclohexen-1-one
CAS Registry Number 80713-71-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13BrO2
InChI InChI=1S/C9H13BrO2/c1-5-7(10)6(11)4-9(2,3)8(5)12/h6,11H,4H2,1-3H3/t6-/m1/s1
InChIKey DSGUMCWHIDMEQS-ZCFIWIBFSA-N
Molecular Weight 233.105 g/mol
SMILES O[C@]1(C(=C(C(C(C1)(C)C)=O)C)Br)[H]
SPLASH splash10-00or-9800000000-60cac6abcaa273e17311
Source of Spectrum H-64-2460-0
Wiley ID 1233237