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1,3-cyclohexanedicarboxylic acid, 4-hydroxy-4-methyl-2-[4-(1-methylethyl)phenyl]-6-oxo-, diethyl ester
SpectraBase Compound ID IGB6vr1k17B
InChI InChI=1S/C22H30O6/c1-6-27-20(24)18-16(23)12-22(5,26)19(21(25)28-7-2)17(18)15-10-8-14(9-11-15)13(3)4/h8-11,13,17-19,26H,6-7,12H2,1-5H3
InChIKey HFTTWJOZPDZNPT-UHFFFAOYSA-N
Mol Weight 390.48 g/mol
Molecular Formula C22H30O6
Exact Mass 390.204239 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 80ec72DxUl6
Name 1,3-cyclohexanedicarboxylic acid, 4-hydroxy-4-methyl-2-[4-(1-methylethyl)phenyl]-6-oxo-, diethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 390.204238680 u
Formula C22H30O6
InChI InChI=1S/C22H30O6/c1-6-27-20(24)18-16(23)12-22(5,26)19(21(25)28-7-2)17(18)15-10-8-14(9-11-15)13(3)4/h8-11,13,17-19,26H,6-7,12H2,1-5H3
InChIKey HFTTWJOZPDZNPT-UHFFFAOYSA-N
Molecular Weight 390.476 g/mol
NMR Offset 16.579
NMR Spectrometer Frequency 250.133
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_376
Solvent DMSO-d6
Source Vendor ID: ZI/8076223; Lab Info: GEI; Lab Number: GEI-0004763
Temperature 23.85 °C