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(2S,4R)-2-(2-HYDROXYPHENYL)-3-(ACETYL)-THIAZOLIDINE-4-[N-(2-NITROOXYETHYL)]-CARBOXAMIDE;CONFORMER-#1
SpectraBase Compound ID EUdPmw5I9AV
InChI InChI=1S/C14H17N3O6S/c1-9(18)16-11(13(20)15-6-7-23-17(21)22)8-24-14(16)10-4-2-3-5-12(10)19/h2-5,11,14,19H,6-8H2,1H3,(H,15,20)/t11-,14-/m0/s1
InChIKey SQOQCZULIAAZCF-FZMZJTMJSA-N
Mol Weight 355.37 g/mol
Molecular Formula C14H17N3O6S
Exact Mass 355.083806 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CL4SPuKKbPm
Name (2S,4R)-2-(2-HYDROXYPHENYL)-3-(ACETYL)-THIAZOLIDINE-4-[N-(2-NITROOXYETHYL)]-CARBOXAMIDE;CONFORMER-#2
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17N3O6S
InChI InChI=1S/C14H17N3O6S/c1-9(18)16-11(13(20)15-6-7-23-17(21)22)8-24-14(16)10-4-2-3-5-12(10)19/h2-5,11,14,19H,6-8H2,1H3,(H,15,20)/t11-,14-/m0/s1
InChIKey SQOQCZULIAAZCF-FZMZJTMJSA-N
Literature Reference Author F.BENEDINI,F.FERRARIO,A.SALA,L.SALA,P.A.SORESINETTI
Literature Reference Citation J.HETCYCL.CHEM.,31,1343(1994)
Literature Reference DOI 10.1002/jhet.5570310608
Molecular Weight 355.365 g/mol
Solvent DMSO-D6;C=0.1M
Source File Reference UWCS16488