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(Z)-Ethyl 3-thienyl-2-(triphenylphosphoranylideneimino)prop-2-enoate
SpectraBase Compound ID 6wRn3L1bXWr
InChI InChI=1S/C27H24NO2PS/c1-2-30-27(29)26(20-22-18-19-32-21-22)28-31(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-21H,2H2,1H3/b26-20-
InChIKey LIXBIRDGDXCBHX-QOMWVZHYSA-N
Mol Weight 457.53 g/mol
Molecular Formula C27H24NO2PS
Exact Mass 457.126537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Itaj2dng7cR
Name (Z)-Ethyl 3-thienyl-2-(triphenylphosphoranylideneimino)prop-2-enoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 457.126537187 u
Formula C27H24NO2PS
InChI InChI=1S/C27H24NO2PS/c1-2-30-27(29)26(20-22-18-19-32-21-22)28-31(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-21H,2H2,1H3/b26-20-
InChIKey LIXBIRDGDXCBHX-QOMWVZHYSA-N
Molecular Weight 457.528 g/mol
SMILES C1(P(=N\C(=C/C2=CSC=C2)C(=O)OCC)(C2=CC=CC=C2)C2=CC=CC=C2)=CC=CC=C1