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1-(2-AMINO-5-NITRO-3-THIENYL)-ETHANONE

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1-(2-AMINO-5-NITRO-3-THIENYL)-ETHANONE
SpectraBase Compound ID Ko1OcPm0Ecn
InChI InChI=1S/C6H6N2O3S/c1-3(9)4-2-5(8(10)11)12-6(4)7/h2H,7H2,1H3
InChIKey VOZSABVICTUWLY-UHFFFAOYSA-N
Mol Weight 186.19 g/mol
Molecular Formula C6H6N2O3S
Exact Mass 186.009913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GZmRvTayt6q
Name 1-(2-AMINO-5-NITRO-3-THIENYL)-ETHANONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H6N2O3S
InChI InChI=1S/C6H6N2O3S/c1-3(9)4-2-5(8(10)11)12-6(4)7/h2H,7H2,1H3
InChIKey VOZSABVICTUWLY-UHFFFAOYSA-N
Literature Reference Author G.A.ELLER,W.HOLZER
Literature Reference Citation MOLECULES,11,371(2006)
Literature Reference DOI 10.3390/11050371
Molecular Weight 186.185 g/mol
Sample ID 46239
Solvent DMSO-D6