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3-Methoxycarbonyl-2-methoxycarbonylmethyl-1H-pyrrolo(2,1-C)(1,4)benzothiazin-1-one
SpectraBase Compound ID 3NUSdniXpqu
InChI InChI=1S/C16H13NO5S/c1-21-13(18)7-9-14(16(20)22-2)11-8-23-12-6-4-3-5-10(12)17(11)15(9)19/h3-6,8H,7H2,1-2H3
InChIKey MGYYISHCHQYZMM-UHFFFAOYSA-N
Mol Weight 331.34 g/mol
Molecular Formula C16H13NO5S
Exact Mass 331.051444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Yc6aXWjBGL
Name 3-Methoxycarbonyl-2-methoxycarbonylmethyl-1H-pyrrolo(2,1-C)(1,4)benzothiazin-1-one
CAS Registry Number 112330-43-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H13NO5S
InChI InChI=1S/C16H13NO5S/c1-21-13(18)7-9-14(16(20)22-2)11-8-23-12-6-4-3-5-10(12)17(11)15(9)19/h3-6,8H,7H2,1-2H3
InChIKey MGYYISHCHQYZMM-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference G. Trapani, A. Reho, A. Latrofa, G.Liso, J. Chem. Soc. Perkin I 1027 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3