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isopropyl {[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]sulfanyl}acetate
SpectraBase Compound ID 2YyZOO5AguD
InChI InChI=1S/C21H22N4O5S/c1-11(2)30-17(26)10-31-21-14(9-23)18(13(8-22)20(24)25-21)12-6-15(27-3)19(29-5)16(7-12)28-4/h6-7,11H,10H2,1-5H3,(H2,24,25)
InChIKey GFQWILMJKFPGDV-UHFFFAOYSA-N
Mol Weight 442.49 g/mol
Molecular Formula C21H22N4O5S
Exact Mass 442.131091 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8GvZQLrAem
Name isopropyl {[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]sulfanyl}acetate
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/C21H22N4O5S/c1-11(2)30-17(26)10-31-21-14(9-23)18(13(8-22)20(24)25-21)12-6-15(27-3)19(29-5)16(7-12)28-4/h6-7,11H,10H2,1-5H3,(H2,24,25)
InChIKey GFQWILMJKFPGDV-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_9920
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: 132527; Labnumber: SHES1-076; VK_ID: VK-009924
Temperature 318 °C