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6-(BROMOMETHYL)-2-METHYL-6,7-DIHYDRO-2H-OXAZOLO-[3,2-B]-PYRAZOLO-[4,3-E]-[1,2,4]-THIADIAZINE-9,9-DIOXIDE
SpectraBase Compound ID CLkiaDNqqEG
InChI InChI=1S/C8H9BrN4O3S/c1-12-4-6-7(11-12)17(14,15)13-3-5(2-9)16-8(13)10-6/h4-5H,2-3H2,1H3
InChIKey PIVOCYLCAUBXAH-UHFFFAOYSA-N
Mol Weight 321.15 g/mol
Molecular Formula C8H9BrN4O3S
Exact Mass 319.957874 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ArJTJrrO5DK
Name 6-(BROMOMETHYL)-2-METHYL-6,7-DIHYDRO-2H-OXAZOLO-[3,2-B]-PYRAZOLO-[4,3-E]-[1,2,4]-THIADIAZINE-9,9-DIOXIDE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H9BrN4O3S
InChI InChI=1S/C8H9BrN4O3S/c1-12-4-6-7(11-12)17(14,15)13-3-5(2-9)16-8(13)10-6/h4-5H,2-3H2,1H3
InChIKey PIVOCYLCAUBXAH-UHFFFAOYSA-N
Literature Reference Author S.VEGA,M.E.ARRANZ,V.J.ARAN
Literature Reference Citation J.HETCYCL.CHEM.,42,755(2005)
Literature Reference DOI 10.1002/jhet.5570420503
Molecular Weight 321.148 g/mol
Sample ID 61089
Solvent DMSO-D6