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(2S,4R)-2-PHENYL-3-(CARBETHOXY)-THIAZOLIDINE-4-[N-(2-NITROOXYETHYL)]-CARBOXAMIDE;CONFORMER-#1
SpectraBase Compound ID 1P1kLJXjmFv
InChI InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-12(13(19)16-8-9-24-18(21)22)10-25-14(17)11-6-4-3-5-7-11/h3-7,12,14H,2,8-10H2,1H3,(H,16,19)/t12-,14-/m1/s1
InChIKey UDFXWPBZXDZJLU-TZMCWYRMSA-N
Mol Weight 369.39 g/mol
Molecular Formula C15H19N3O6S
Exact Mass 369.099457 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5b7KZ2pl7wU
Name (2S,4R)-2-PHENYL-3-(CARBETHOXY)-THIAZOLIDINE-4-[N-(2-NITROOXYETHYL)]-CARBOXAMIDE;CONFORMER-#2
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H19N3O6S
InChI InChI=1S/C15H19N3O6S/c1-2-23-15(20)17-12(13(19)16-8-9-24-18(21)22)10-25-14(17)11-6-4-3-5-7-11/h3-7,12,14H,2,8-10H2,1H3,(H,16,19)/t12-,14-/m1/s1
InChIKey UDFXWPBZXDZJLU-TZMCWYRMSA-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 369.392 g/mol
Solvent DMSO-D6;C=0.1M
Source File Reference UWCS16486