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TRANS-PERHYDRO-1,4-OXAZEPIN-3-THIONE

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TRANS-PERHYDRO-1,4-OXAZEPIN-3-THIONE
SpectraBase Compound ID KeKj2AoANij
InChI InChI=1S/C9H15NOS/c12-9-6-11-8-4-2-1-3-7(8)5-10-9/h7-8H,1-6H2,(H,10,12)/t7-,8+/m1/s1
InChIKey GNIQVODPRXXNJL-SFYZADRCSA-N
Mol Weight 185.28 g/mol
Molecular Formula C9H15NOS
Exact Mass 185.087435 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DvEx1BcxTGH
Name TRANS-PERHYDRO-1,4-OXAZEPIN-3-THIONE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H15NOS
InChI InChI=1S/C9H15NOS/c12-9-6-11-8-4-2-1-3-7(8)5-10-9/h7-8H,1-6H2,(H,10,12)/t7-,8+/m1/s1
InChIKey GNIQVODPRXXNJL-SFYZADRCSA-N
Literature Reference Author L.SIMON,S.G.TALPAS,F.FUELOEP,G.BERNATH,G.ARGAY,A.KALMAN,P.SO HAR
Literature Reference Citation J.HETCYCL.CHEM.,32,161(1995)
Literature Reference DOI 10.1002/jhet.5570320126
Molecular Weight 185.284 g/mol
Solvent CDCl3
Source File Reference UWCS20927