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5-AZA-7-BROMO-4-OXO-3-THIAHEPTANOIC ACID
SpectraBase Compound ID GSBpFy0ra4X
InChI InChI=1S/C5H8BrNO3S/c6-1-2-7-5(10)11-3-4(8)9/h1-3H2,(H,7,10)(H,8,9)
InChIKey KJVDIPIYCZXKAO-UHFFFAOYSA-N
Mol Weight 242.09 g/mol
Molecular Formula C5H8BrNO3S
Exact Mass 240.940827 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HImwqHrarmU
Name 5-AZA-7-BROMO-4-OXO-3-THIAHEPTANOIC ACID
Comments QîÀ
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H8BrNO3S
InChI InChI=1S/C5H8BrNO3S/c6-1-2-7-5(10)11-3-4(8)9/h1-3H2,(H,7,10)(H,8,9)
InChIKey KJVDIPIYCZXKAO-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference N.A.NEDOLYA, N.P.PAPSHEVA, A.V.AFONIN, V.A.KUKHAREVA, T.V.KASHIK, B.A.TROFIMOV(1993) Izv.Akad.Nauk SSSR(Russ. Lang.): N2, 350-354.
NMR Standard HMDS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6O ethanol-d6