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Ethyl 2-Cyano-2-(p-methoxyphenyl)-3-methylpentanoate
SpectraBase Compound ID 2hbhNnmVQbl
InChI InChI=1S/C16H21NO3/c1-5-12(3)16(11-17,15(18)20-6-2)13-7-9-14(19-4)10-8-13/h7-10,12H,5-6H2,1-4H3
InChIKey BZMKARXQFBOHJI-UHFFFAOYSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xXkcDH6US
Name Ethyl 2-Cyano-2-(p-methoxyphenyl)-3-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-5-12(3)16(11-17,15(18)20-6-2)13-7-9-14(19-4)10-8-13/h7-10,12H,5-6H2,1-4H3
InChIKey BZMKARXQFBOHJI-UHFFFAOYSA-N
Molecular Weight 275.348 g/mol
SMILES C(C(=O)OCC)(C#N)(c1ccc(cc1)OC)C(CC)C
SPLASH splash10-014l-0590000000-1cc6a254a4e3db1de02c
Source of Spectrum B-44-369-0
Synonyms Ethyl 2-Cyano-2-(p-methoxyphenyl)-3-methylpentanoate isomer Ethyl 2-cyano-2-(4-methoxyphenyl)-3-methylpentanoate Ethyl 2-cyano-2-(p-methoxyphenyl)-3-methylpentanoate (less polar diastereomer) Ethyl 2-cyano-2-(p-methoxyphenyl)-3-methylpentanoate (more polar diastereomer)
Wiley ID 1279193