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(6E)-6-[3-bromo-4-(dimethylamino)benzylidene]-2-(1-ethylpropyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

View entire compound with spectra: 1 NMR

(6E)-6-[3-bromo-4-(dimethylamino)benzylidene]-2-(1-ethylpropyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
SpectraBase Compound ID GH327A8MoKd
InChI InChI=1S/C19H22BrN5OS/c1-5-12(6-2)18-23-25-16(21)13(17(26)22-19(25)27-18)9-11-7-8-15(24(3)4)14(20)10-11/h7-10,12,21H,5-6H2,1-4H3/b13-9+,21-16?
InChIKey JBWPQTOQXZZMKR-LHTBISBZSA-N
Mol Weight 448.38 g/mol
Molecular Formula C19H22BrN5OS
Exact Mass 447.072845 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7xeEIpBCQo6
Name (6E)-6-[3-bromo-4-(dimethylamino)benzylidene]-2-(1-ethylpropyl)-5-imino-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/C19H22BrN5OS/c1-5-12(6-2)18-23-25-16(21)13(17(26)22-19(25)27-18)9-11-7-8-15(24(3)4)14(20)10-11/h7-10,12,21H,5-6H2,1-4H3/b13-9+,21-16?
InChIKey JBWPQTOQXZZMKR-LHTBISBZSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_25872
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: D61694; Labnumber: CEP4-3781; SBI_ID: SBI-025876
Synonyms 6-[3-bromo-4-(dimethylamino)benzylidene]-2-(1-ethylpropyl)-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Temperature 318 °C