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(2E)-N-(3-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}propyl)-3-(5-nitro-2-furyl)-2-propenamide
SpectraBase Compound ID 2KgXh2Ifj4j
InChI InChI=1S/C19H21F3N4O4S/c1-18(2,3)13-11-14(19(20,21)22)25-17(24-13)31-10-4-9-23-15(27)7-5-12-6-8-16(30-12)26(28)29/h5-8,11H,4,9-10H2,1-3H3,(H,23,27)/b7-5+
InChIKey HVNZEIOWMBFYMG-FNORWQNLSA-N
Mol Weight 458.46 g/mol
Molecular Formula C19H21F3N4O4S
Exact Mass 458.123561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EwOLH8b62fU
Name (2E)-N-(3-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}propyl)-3-(5-nitro-2-furyl)-2-propenamide
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/C19H21F3N4O4S/c1-18(2,3)13-11-14(19(20,21)22)25-17(24-13)31-10-4-9-23-15(27)7-5-12-6-8-16(30-12)26(28)29/h5-8,11H,4,9-10H2,1-3H3,(H,23,27)/b7-5+
InChIKey HVNZEIOWMBFYMG-FNORWQNLSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_664
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/1007652; UBI_ID: UBI-000665
Synonyms N-(3-{[4-tert-butyl-6-(trifluoromethyl)-2-pyrimidinyl]sulfanyl}propyl)-3-(5-nitro-2-furyl)-2-propenamide
Temperature 308 °C