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diethyl 4-hydroxy-4-methyl-6-oxo-2-(phenylethynyl)-1,3-cyclohexanedicarboxylate
SpectraBase Compound ID GoxQHFr3PB4
InChI InChI=1S/C21H24O6/c1-4-26-19(23)17-15(12-11-14-9-7-6-8-10-14)18(20(24)27-5-2)21(3,25)13-16(17)22/h6-10,15,17-18,25H,4-5,13H2,1-3H3
InChIKey MOXCOLXPODXBCR-UHFFFAOYSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ClpFltTW3i8
Name diethyl 4-hydroxy-4-methyl-6-oxo-2-(phenylethynyl)-1,3-cyclohexanedicarboxylate
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/C21H24O6/c1-4-26-19(23)17-15(12-11-14-9-7-6-8-10-14)18(20(24)27-5-2)21(3,25)13-16(17)22/h6-10,15,17-18,25H,4-5,13H2,1-3H3
InChIKey MOXCOLXPODXBCR-UHFFFAOYSA-N
NMR Offset 17.9114
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31937
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: 1843841; SBI_ID: SBI-031941
Temperature 303 °C