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methyl (1R,2S,3R,8aS)-6-acetyl-3-(aminocarbonyl)-1-cyano-2-(2,3-dichlorophenyl)-1,2,3,8a-tetrahydro-1-indolizinecarboxylate

View entire compound with spectra: 1 NMR

methyl (1R,2S,3R,8aS)-6-acetyl-3-(aminocarbonyl)-1-cyano-2-(2,3-dichlorophenyl)-1,2,3,8a-tetrahydro-1-indolizinecarboxylate
SpectraBase Compound ID AmTgIR26ei
InChI InChI=1S/C20H17Cl2N3O4/c1-10(26)11-6-7-14-20(9-23,19(28)29-2)15(17(18(24)27)25(14)8-11)12-4-3-5-13(21)16(12)22/h3-8,14-15,17H,1-2H3,(H2,24,27)
InChIKey YVKGSHONDCACAF-UHFFFAOYSA-N
Mol Weight 434.28 g/mol
Molecular Formula C20H17Cl2N3O4
Exact Mass 433.059611 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6AVtZ7J5f14
Name methyl (1R,2S,3R,8aS)-6-acetyl-3-(aminocarbonyl)-1-cyano-2-(2,3-dichlorophenyl)-1,2,3,8a-tetrahydro-1-indolizinecarboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H17Cl2N3O4/c1-10(26)11-6-7-14-20(9-23,19(28)29-2)15(17(18(24)27)25(14)8-11)12-4-3-5-13(21)16(12)22/h3-8,14-15,17H,1-2H3,(H2,24,27)
InChIKey YVKGSHONDCACAF-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_10551
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: 132634; Labnumber: SHES1-193; VK_ID: VK-010555
Temperature 308 °C