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7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[(5-bromo-2-methoxyphenyl)methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
SpectraBase Compound ID FYJJj6AZuHG
InChI InChI=1S/C16H15BrN4O2S/c1-8(2)15-20-21-13(18)11(14(22)19-16(21)24-15)7-9-6-10(17)4-5-12(9)23-3/h4-8,18H,1-3H3/b11-7-,18-13?
InChIKey VXUUJDWCPCERNV-YTQSSNFRSA-N
Mol Weight 407.29 g/mol
Molecular Formula C16H15BrN4O2S
Exact Mass 406.00991 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4nc3YmDjzbn
Name 7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one, 6-[(5-bromo-2-methoxyphenyl)methylene]-5,6-dihydro-5-imino-2-(1-methylethyl)-, (6Z)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.009909911 u
Formula C16H15BrN4O2S
InChI InChI=1S/C16H15BrN4O2S/c1-8(2)15-20-21-13(18)11(14(22)19-16(21)24-15)7-9-6-10(17)4-5-12(9)23-3/h4-8,18H,1-3H3/b11-7-,18-13?
InChIKey VXUUJDWCPCERNV-YTQSSNFRSA-N
Molecular Weight 407.286 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15621
Solvent DMSO-d6
Source Vendor ID: ZI/10033625; Lab Info: CEP; Lab Number: CEP-6700121