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Ethyl (E) and (Z)-4-Benzyloxy-2-isocyano-3-methyl-3-butenoate
SpectraBase Compound ID L6ZuEmxl9IS
InChI InChI=1S/C15H17NO3/c1-4-19-15(17)14(16-3)12(2)10-18-11-13-8-6-5-7-9-13/h5-10,14H,4,11H2,1-2H3/b12-10+
InChIKey KMQBETPAPGPVKL-ZRDIBKRKSA-N
Mol Weight 259.3 g/mol
Molecular Formula C15H17NO3
Exact Mass 259.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DCJe1n9kswU
Name Ethyl (E) and (Z)-4-Benzyloxy-2-isocyano-3-methyl-3-butenoate
Comments Less than 3 mono-isotopic peaks
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Formula C15H17NO3
InChI InChI=1S/C15H17NO3/c1-4-19-15(17)14(16-3)12(2)10-18-11-13-8-6-5-7-9-13/h5-10,14H,4,11H2,1-2H3/b12-10+
InChIKey KMQBETPAPGPVKL-ZRDIBKRKSA-N
Molecular Weight 259.305 g/mol
SMILES C(C(\C(=C\OCc1ccccc1)C)[N+]#[C-])(=O)OCC
SPLASH splash10-0006-9010000000-01059804f610bbad5d67
Source of Spectrum AJ-72-2311-4
Synonyms Ethyl 4-Benzyloxy-2-isocyano-3-methyl-3-butenoate ethyl (3E)-4-(benzyloxy)-2-isocyano-3-methylbut-3-enoate Ethyl (E)-4-Benzyloxy-2-isocyano-3-methyl-3-butenoate
Wiley ID 775238