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Benzyl (E)-4-Benzyloxy-3-ethyl-2-isocyano-3-butenoate
SpectraBase Compound ID 4YbFQzgBkzt
InChI InChI=1S/C21H21NO3/c1-3-19(16-24-14-17-10-6-4-7-11-17)20(22-2)21(23)25-15-18-12-8-5-9-13-18/h4-13,16,20H,3,14-15H2,1H3/b19-16+
InChIKey HGYDLFQRGREFJM-KNTRCKAVSA-N
Mol Weight 335.4 g/mol
Molecular Formula C21H21NO3
Exact Mass 335.152144 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HrvMg3DPA5
Name Benzyl (E)-4-Benzyloxy-3-ethyl-2-isocyano-3-butenoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO3
InChI InChI=1S/C21H21NO3/c1-3-19(16-24-14-17-10-6-4-7-11-17)20(22-2)21(23)25-15-18-12-8-5-9-13-18/h4-13,16,20H,3,14-15H2,1H3/b19-16+
InChIKey HGYDLFQRGREFJM-KNTRCKAVSA-N
Molecular Weight 335.403 g/mol
SMILES C([N+]#[C-])(C(OCc1ccccc1)=O)\C(=C\OCc1ccccc1)CC
SPLASH splash10-0006-9043000000-43a5482c087c06795bcc
Source of Spectrum AJ-72-2312-2
Synonyms benzyl (3E)-3-[(benzyloxy)methylidene]-2-isocyanopentanoate
Wiley ID 775235
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