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2-[[5-(4-Bromophenyl)-2-furyl](2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one

View entire compound with spectra: 2 NMR

2-[[5-(4-Bromophenyl)-2-furyl](2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one
SpectraBase Compound ID JATJSiiicy
InChI InChI=1S/C27H29BrO5/c1-26(2)11-17(29)23(18(30)12-26)25(24-19(31)13-27(3,4)14-20(24)32)22-10-9-21(33-22)15-5-7-16(28)8-6-15/h5-10,25,29,31H,11-14H2,1-4H3
InChIKey KZJNOIYPACFRSV-UHFFFAOYSA-N
Mol Weight 513.43 g/mol
Molecular Formula C27H29BrO5
Exact Mass 512.119837 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID G6inWHBFW6p
Name 2-[[5-(4-bromophenyl)-2-furyl](2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)methyl]-3-hydroxy-5,5-dimethyl-2-cyclohexen-1-one
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C27H29BrO5/c1-26(2)11-17(29)23(18(30)12-26)25(24-19(31)13-27(3,4)14-20(24)32)22-10-9-21(33-22)15-5-7-16(28)8-6-15/h5-10,25,29,31H,11-14H2,1-4H3
InChIKey KZJNOIYPACFRSV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_8377
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/7120259; Labnumber: DAK-0000031; UZI_ID: UZI-008379
Temperature 318 °C