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(6E)-2-(1-ethylpropyl)-5-imino-6-(4-isopropylbenzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID IzVd6EkbOUT
InChI InChI=1S/C20H24N4OS/c1-5-14(6-2)19-23-24-17(21)16(18(25)22-20(24)26-19)11-13-7-9-15(10-8-13)12(3)4/h7-12,14,21H,5-6H2,1-4H3/b16-11+,21-17?
InChIKey BNESJBKWWKYRGM-SUIAZJLOSA-N
Mol Weight 368.5 g/mol
Molecular Formula C20H24N4OS
Exact Mass 368.167083 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID E7XXeoW0qAL
Name (6E)-2-(1-ethylpropyl)-5-imino-6-(4-isopropylbenzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
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/C20H24N4OS/c1-5-14(6-2)19-23-24-17(21)16(18(25)22-20(24)26-19)11-13-7-9-15(10-8-13)12(3)4/h7-12,14,21H,5-6H2,1-4H3/b16-11+,21-17?
InChIKey BNESJBKWWKYRGM-SUIAZJLOSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25849
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: D61669; Labnumber: CEP4-3666; SBI_ID: SBI-025853
Synonyms 2-(1-ethylpropyl)-5-imino-6-(4-isopropylbenzylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C