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5-Amino-2-butyl-2H-1,2,6-thiadiazin-3(4H)-one 1,1-dioxide
SpectraBase Compound ID 1LiiqIS3mfq
InChI InChI=1S/C7H13N3O3S/c1-2-3-4-10-7(11)5-6(8)9-14(10,12)13/h2-5H2,1H3,(H2,8,9)
InChIKey LSRAFXHJKLTZCU-UHFFFAOYSA-N
Mol Weight 219.26 g/mol
Molecular Formula C7H13N3O3S
Exact Mass 219.067762 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KEYiiZ0EAXA
Name 5-Amino-2-butyl-2H-1,2,6-thiadiazin-3(4H)-one 1,1-dioxide
CAS Registry Number 115347-03-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H13N3O3S
InChI InChI=1S/C7H13N3O3S/c1-2-3-4-10-7(11)5-6(8)9-14(10,12)13/h2-5H2,1H3,(H2,8,9)
InChIKey LSRAFXHJKLTZCU-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference I. Alkorta, V.J. Aran, A.G. Bielsa, J. Chem. Soc. Perkin I 1271 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6