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2-THIOMETHYL-4H-3,1-BENZOXAZIN-4-ONE

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2-THIOMETHYL-4H-3,1-BENZOXAZIN-4-ONE
SpectraBase Compound ID 5bi1qH92u1j
InChI InChI=1S/C9H7NO2S/c1-13-9-10-7-5-3-2-4-6(7)8(11)12-9/h2-5H,1H3
InChIKey KFSXSHARFWOYTD-UHFFFAOYSA-N
Mol Weight 193.22 g/mol
Molecular Formula C9H7NO2S
Exact Mass 193.01975 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DrTfWCEaFTC
Name 2-Methylthio-benzoxazinone-4
CAS Registry Number 708-77-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7NO2S
InChI InChI=1S/C9H7NO2S/c1-13-9-10-7-5-3-2-4-6(7)8(11)12-9/h2-5H,1H3
InChIKey KFSXSHARFWOYTD-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference V.J. Robinson, R.W. Spencer, Can. J. Chem. 66, 416 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6