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(3-E,5-R)-6-BROMO-6-METHYL-5-(2-METHOXYMETHYLOXYETHYL)-3-HEPTEN-2-ONE
SpectraBase Compound ID 94HU0Q8gqtF
InChI InChI=1S/C12H21BrO3/c1-10(14)5-6-11(12(2,3)13)7-8-16-9-15-4/h5-6,11H,7-9H2,1-4H3/b6-5+/t11-/m1/s1
InChIKey KNHSMEQEYHQPSE-MVIFTORASA-N
Mol Weight 293.2 g/mol
Molecular Formula C12H21BrO3
Exact Mass 292.067408 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9P9Wfh7Lqd
Name (3-E,5-R)-6-BROMO-6-METHYL-5-(2-METHOXYMETHYLOXYETHYL)-3-HEPTEN-2-ONE
Compound Number XI
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H21BrO3
InChI InChI=1S/C12H21BrO3/c1-10(14)5-6-11(12(2,3)13)7-8-16-9-15-4/h5-6,11H,7-9H2,1-4H3/b6-5+/t11-/m1/s1
InChIKey KNHSMEQEYHQPSE-MVIFTORASA-N
Literature Reference Author F.A.GIMALOVA-AKBUTINA,I.F.SADRETDINOV,L.V.SPIRIKHIN,M.S.MIFT AKHOV
Literature Reference Citation RUSS.J.ORG.CHEM.,39,1234(2003)
Literature Reference DOI 10.1023/B:RUJO.0000010207.63528.f6
Molecular Weight 293.201 g/mol
Solvent CDCl3
Source File Reference UWMZ23498