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BENZYL-3,6-DIHYDRO-3-PHENYL-1-LAMBDA(4),2-THIAZINE-2-CARBOXYLATE;ISOMER-CIS
SpectraBase Compound ID 47VVCiTvh85
InChI InChI=1S/C18H17NO3S/c20-18(22-14-15-8-3-1-4-9-15)19-17(12-7-13-23(19)21)16-10-5-2-6-11-16/h1-12,17H,13-14H2/t17-,23?/m1/s1
InChIKey KYEKQBNESWPWAC-LIXIDFRTSA-N
Mol Weight 327.4 g/mol
Molecular Formula C18H17NO3S
Exact Mass 327.092915 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2jbY95C35t4
Name BENZYL-3,6-DIHYDRO-3-PHENYL-1-LAMBDA(4),2-THIAZINE-2-CARBOXYLATE;ISOMER-CIS
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17NO3S
InChI InChI=1S/C18H17NO3S/c20-18(22-14-15-8-3-1-4-9-15)19-17(12-7-13-23(19)21)16-10-5-2-6-11-16/h1-12,17H,13-14H2/t17-,23?/m1/s1
InChIKey KYEKQBNESWPWAC-LIXIDFRTSA-N
Literature Reference Author M.M.ENDESHAW,A.BAYER,L.K.HANSEN,O.R.GAUTUN
Literature Reference Citation EUR.J.ORG.CHEM.,5249(2006)
Molecular Weight 327.398 g/mol
Sample ID 32941
Solvent CDCl3