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ethyl 2-amino-5-cyano-6-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}nicotinate
SpectraBase Compound ID 5f6hZEaSSvj
InChI InChI=1S/C16H20N4O3S/c1-2-23-16(22)12-7-10(8-17)15(20-14(12)18)24-9-13(21)19-11-5-3-4-6-11/h7,11H,2-6,9H2,1H3,(H2,18,20)(H,19,21)
InChIKey YUCWAZSFFSODCT-UHFFFAOYSA-N
Mol Weight 348.42 g/mol
Molecular Formula C16H20N4O3S
Exact Mass 348.125612 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FrUwCM6CyID
Name ethyl 2-amino-5-cyano-6-{[2-(cyclopentylamino)-2-oxoethyl]sulfanyl}nicotinate
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/C16H20N4O3S/c1-2-23-16(22)12-7-10(8-17)15(20-14(12)18)24-9-13(21)19-11-5-3-4-6-11/h7,11H,2-6,9H2,1H3,(H2,18,20)(H,19,21)
InChIKey YUCWAZSFFSODCT-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_18349
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: UZI/1263657; Labnumber: TSQ0344; UZI_ID: UZI-018356
Temperature 308 °C