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4-[4-Methyl-2-(1-methylethyl)-5-oxo-2,5-dihydrofuran-3-yl]benzonitrile
SpectraBase Compound ID CWlvdZuBeQ9
InChI InChI=1S/C15H15NO2/c1-9(2)14-13(10(3)15(17)18-14)12-6-4-11(8-16)5-7-12/h4-7,9,14H,1-3H3
InChIKey ZBJGTBPPYJRYNQ-UHFFFAOYSA-N
Mol Weight 241.29 g/mol
Molecular Formula C15H15NO2
Exact Mass 241.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4bE1fuRlA0
Name 4-[4-Methyl-2-(1-methylethyl)-5-oxo-2,5-dihydrofuran-3-yl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15NO2
InChI InChI=1S/C15H15NO2/c1-9(2)14-13(10(3)15(17)18-14)12-6-4-11(8-16)5-7-12/h4-7,9,14H,1-3H3
InChIKey ZBJGTBPPYJRYNQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000159
Molecular Weight 241.290 g/mol
SMILES C(c1ccc(cc1)C=1C(OC(C1C)=O)C(C)C)#N
SPLASH splash10-0002-1920000000-c71d27ffc809fa2eb567
Source of Spectrum ASC-352-1307/SM17-4ab
Synonyms 4-(2-isopropyl-4-methyl-5-oxo-2,5-dihydrofuran-3-yl)benzonitrile 4-(4-Methyl-5-oxo-2-propan-2-yl-2H-furan-3-yl)benzonitrile 4-(2-isopropyl-4-methyl-5-oxo-2H-furan-3-yl)benzonitrile 4-(4-Methyl-5-oxidanylidene-2-propan-2-yl-2H-furan-3-yl)benzenecarbonitrile
Wiley ID 1764489