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1H-xanthen-1-one, 7-bromo-2,3,4,9-tetrahydro-9-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3,3-dimethyl-

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1H-xanthen-1-one, 7-bromo-2,3,4,9-tetrahydro-9-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3,3-dimethyl-
SpectraBase Compound ID 4UdsGdU9Z3Z
InChI InChI=1S/C23H25BrO4/c1-22(2)8-14(25)20(15(26)9-22)19-13-7-12(24)5-6-17(13)28-18-11-23(3,4)10-16(27)21(18)19/h5-7,19,25H,8-11H2,1-4H3
InChIKey KKGFFQSFDZJSEK-UHFFFAOYSA-N
Mol Weight 445.35 g/mol
Molecular Formula C23H25BrO4
Exact Mass 444.093622 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6ZMxYeVHOBI
Name 1H-xanthen-1-one, 7-bromo-2,3,4,9-tetrahydro-9-(2-hydroxy-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)-3,3-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.093622281 u
Formula C23H25BrO4
InChI InChI=1S/C23H25BrO4/c1-22(2)8-14(25)20(15(26)9-22)19-13-7-12(24)5-6-17(13)28-18-11-23(3,4)10-16(27)21(18)19/h5-7,19,25H,8-11H2,1-4H3
InChIKey KKGFFQSFDZJSEK-UHFFFAOYSA-N
Molecular Weight 445.353 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5161
Solvent DMSO-d6
Source Vendor ID: NMR/9312963; Lab Info: KOZ; Lab Number: KOZ-0001645