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(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylate

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(1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylate
SpectraBase Compound ID 1rfNdy8WJhQ
InChI InChI=1S/C21H24ClFN2O3/c1-13-18(20(24-28-13)19-15(22)7-4-8-16(19)23)21(26)27-12-14-6-5-11-25-10-3-2-9-17(14)25/h4,7-8,14,17H,2-3,5-6,9-12H2,1H3
InChIKey QYZGQMBWXMTJIG-UHFFFAOYSA-N
Mol Weight 406.89 g/mol
Molecular Formula C21H24ClFN2O3
Exact Mass 406.145949 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BzwEJlgN370
Name (1R,9aR)-octahydro-2H-quinolizin-1-ylmethyl 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylate
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/C21H24ClFN2O3/c1-13-18(20(24-28-13)19-15(22)7-4-8-16(19)23)21(26)27-12-14-6-5-11-25-10-3-2-9-17(14)25/h4,7-8,14,17H,2-3,5-6,9-12H2,1H3
InChIKey QYZGQMBWXMTJIG-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_12460
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: 100613; Labnumber: TNC-2-5151; VK_ID: VK-012465
Temperature 308 °C