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(2E,6E)-2,6-bis(5-bromo-2-isopropoxybenzylidene)cyclohexanone

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(2E,6E)-2,6-bis(5-bromo-2-isopropoxybenzylidene)cyclohexanone
SpectraBase Compound ID Drj5lwZwblf
InChI InChI=1S/C26H28Br2O3/c1-16(2)30-24-10-8-22(27)14-20(24)12-18-6-5-7-19(26(18)29)13-21-15-23(28)9-11-25(21)31-17(3)4/h8-17H,5-7H2,1-4H3/b18-12+,19-13+
InChIKey KHEAHQWFFUZTHH-KLCVKJMQSA-N
Mol Weight 548.32 g/mol
Molecular Formula C26H28Br2O3
Exact Mass 546.040521 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 88gSlHqAKSm
Name (2E,6E)-2,6-bis(5-bromo-2-isopropoxybenzylidene)cyclohexanone
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H28Br2O3/c1-16(2)30-24-10-8-22(27)14-20(24)12-18-6-5-7-19(26(18)29)13-21-15-23(28)9-11-25(21)31-17(3)4/h8-17H,5-7H2,1-4H3/b18-12+,19-13+
InChIKey KHEAHQWFFUZTHH-KLCVKJMQSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_9120
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/9040110; UBI_ID: UBI-009123
Synonyms 2,6-bis(5-bromo-2-isopropoxybenzylidene)cyclohexanone
Temperature 308 °C