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ETHYL-5-PHENYL-1,3,4-OXADIAZOLE-2-YL-THIOCARBAMOYLMETHYLPHENYLPHOSPHINATE:ISOMER-#1

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ETHYL-5-PHENYL-1,3,4-OXADIAZOLE-2-YL-THIOCARBAMOYLMETHYLPHENYLPHOSPHINATE:ISOMER-#1
SpectraBase Compound ID KROWjQW0N2y
InChI InChI=1S/C18H18N3O3PS/c1-2-23-25(22,14-11-7-4-8-12-14)15(16(19)26)18-21-20-17(24-18)13-9-5-3-6-10-13/h3-12,15H,2H2,1H3,(H2,19,26)
InChIKey WVUBIFSEPXRJOM-UHFFFAOYSA-N
Mol Weight 387.39 g/mol
Molecular Formula C18H18N3O3PS
Exact Mass 387.08065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 34yZa7GZpQq
Name ETHYL-5-PHENYL-1,3,4-OXADIAZOLE-2-YL-THIOCARBAMOYLMETHYLPHENYLPHOSPHINATE:ISOMER-#2
Compound Number 4.4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H18N3O3PS
InChI InChI=1S/C18H18N3O3PS/c1-2-23-25(22,14-11-7-4-8-12-14)15(16(19)26)18-21-20-17(24-18)13-9-5-3-6-10-13/h3-12,15H,2H2,1H3,(H2,19,26)
InChIKey WVUBIFSEPXRJOM-UHFFFAOYSA-N
Literature Reference Author R.NEIDLEIN,M.JOCHHEIM,C.KRIEGER,W.KRAMER
Literature Reference Citation HETEROCYCLES,39,185(1994)
Literature Reference DOI 10.3987/COM-93-S(B)14
Molecular Weight 387.393 g/mol
Solvent DMSO-D6
Source File Reference UWCP7504