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4-thiazolidinone, 3-methyl-5-[[4-[2-(2-phenoxyethoxy)ethoxy]phenyl]methylene]-2-thioxo-, (5E)-
SpectraBase Compound ID Iw8zZwlc1Mx
InChI InChI=1S/C21H21NO4S2/c1-22-20(23)19(28-21(22)27)15-16-7-9-18(10-8-16)26-14-12-24-11-13-25-17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3/b19-15+
InChIKey ZMBNJUNBGATBHB-XDJHFCHBSA-N
Mol Weight 415.52 g/mol
Molecular Formula C21H21NO4S2
Exact Mass 415.091201 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IqcHk6ffBaq
Name 4-Thiazolidinone, 3-methyl-5-[[4-[2-(2-phenoxyethoxy)ethoxy]phenyl]methylene]-2-thioxo-, (5E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.091200504 u
Formula C21H21NO4S2
InChI InChI=1S/C21H21NO4S2/c1-22-20(23)19(28-21(22)27)15-16-7-9-18(10-8-16)26-14-12-24-11-13-25-17-5-3-2-4-6-17/h2-10,15H,11-14H2,1H3/b19-15+
InChIKey ZMBNJUNBGATBHB-XDJHFCHBSA-N
Molecular Weight 415.522 g/mol
SMILES C=1C=CC(OCCOCCOC2=CC=C(\C=C/3C(N(C(S3)=S)C)=O)C=C2)=CC1