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[4-Phenyl-1-(toluene-4-sulfonyl)azetidin-2-ylidene]acetic acid ethyl ester
SpectraBase Compound ID 9xnhEIHW9Zl
InChI InChI=1S/C20H21NO4S/c1-3-25-20(22)14-17-13-19(16-7-5-4-6-8-16)21(17)26(23,24)18-11-9-15(2)10-12-18/h4-12,14,19H,3,13H2,1-2H3/b17-14+
InChIKey XNNZFCYHCLLVJV-SAPNQHFASA-N
Mol Weight 371.45 g/mol
Molecular Formula C20H21NO4S
Exact Mass 371.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 70xdJfLrEyV
Name [4-Phenyl-1-(toluene-4-sulfonyl)azetidin-2-ylidene]acetic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21NO4S
InChI InChI=1S/C20H21NO4S/c1-3-25-20(22)14-17-13-19(16-7-5-4-6-8-16)21(17)26(23,24)18-11-9-15(2)10-12-18/h4-12,14,19H,3,13H2,1-2H3/b17-14+
InChIKey XNNZFCYHCLLVJV-SAPNQHFASA-N
Molecular Weight 371.451 g/mol
SMILES C(\C=C\1N(S(c2ccc(cc2)C)(=O)=O)C(C1)c1ccccc1)(=O)OCC
SPLASH splash10-0536-8490000000-b187a9bdfd53b614b239
Source of Spectrum F-70-9984-1
Synonyms Ethyl (2E)-{1-[(4-methylphenyl)sulfonyl]-4-phenyl-2-azetidinylidene}ethanoate
Wiley ID 1597915