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3-Methoxycarbonyl-5-methyl-2-(4-methoxyphenyl)-hex-4-ene nitrile
SpectraBase Compound ID BlJPyKm1EOz
InChI InChI=1S/C16H19NO3/c1-11(2)9-14(16(18)20-4)15(10-17)12-5-7-13(19-3)8-6-12/h5-9,14-15H,1-4H3
InChIKey BHUAHAQJRGKSMR-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkZ6bGC12Hm
Name 3-Methoxycarbonyl-5-methyl-2-(4-methoxyphenyl)-hex-4-ene nitrile
CAS Registry Number 118089-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-11(2)9-14(16(18)20-4)15(10-17)12-5-7-13(19-3)8-6-12/h5-9,14-15H,1-4H3
InChIKey BHUAHAQJRGKSMR-UHFFFAOYSA-N
Molecular Weight 273.332 g/mol
SMILES C(C(C#N)c1ccc(cc1)OC)(C=C(C)C)C(=O)OC
SPLASH splash10-0002-2900000000-69fa36eb8f58d45a0e5f
Source of Spectrum F-46-1274-6
Synonyms Methyl 2-[cyano(4-methoxyphenyl)methyl]-4-methyl-3-pentenoate
Wiley ID 1277307