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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-(1,3-benzodioxol-5-ylmethylene)-5,6-dihydro-5-imino-2-(2-methylpropyl)-, (6Z)-
SpectraBase Compound ID 6nUpUbJE14e
InChI InChI=1S/C17H16N4O3S/c1-9(2)5-14-20-21-15(18)11(16(22)19-17(21)25-14)6-10-3-4-12-13(7-10)24-8-23-12/h3-4,6-7,9,18H,5,8H2,1-2H3/b11-6-,18-15?
InChIKey FRKWVMGPOZUNQY-QARVSLNCSA-N
Mol Weight 356.4 g/mol
Molecular Formula C17H16N4O3S
Exact Mass 356.094312 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6hHMojPlE6F
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-(1,3-benzodioxol-5-ylmethylene)-5,6-dihydro-5-imino-2-(2-methylpropyl)-, (6Z)-
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/C17H16N4O3S/c1-9(2)5-14-20-21-15(18)11(16(22)19-17(21)25-14)6-10-3-4-12-13(7-10)24-8-23-12/h3-4,6-7,9,18H,5,8H2,1-2H3/b11-6-,18-15?
InChIKey FRKWVMGPOZUNQY-QARVSLNCSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_2550
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: NMR/11269220