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1-METHYLTHIO-3-METHYL-2-HYDROXYBENZOPYRROLIZIDIN-5-ONE
SpectraBase Compound ID 5moSsy54w0B
InChI InChI=1S/C13H13NO2S/c1-7-11(15)12(17-2)10-8-5-3-4-6-9(8)13(16)14(7)10/h3-7,11,15H,1-2H3/t7-,11-/m1/s1
InChIKey WNXLNUFPMOMAGB-RDDDGLTNSA-N
Mol Weight 247.31 g/mol
Molecular Formula C13H13NO2S
Exact Mass 247.0667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4oZZ1J2KV8v
Name 1-METHYLTHIO-3-METHYL-2-HYDROXYBENZOPYRROLIZIDIN-5-ONE
Comments _R
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H13NO2S
InChI InChI=1S/C13H13NO2S/c1-7-11(15)12(17-2)10-8-5-3-4-6-9(8)13(16)14(7)10/h3-7,11,15H,1-2H3/t7-,11-/m1/s1
InChIKey WNXLNUFPMOMAGB-RDDDGLTNSA-N
Instrument Name Bruker AM-300
Literature Reference L.M.KHALILOV, V.S.SULTANOVA, S.N.LAKEEV, F.Z.GALIN, L.F.CHERTANOVA,G.A.TOLSTIKOV (1991) Izv.Akad.Nauk SSSR(Russ. Lang.): N10, 2298-2302.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d