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4-Methylphenyl .beta.-phenylpropionate
SpectraBase Compound ID 2qUCFshfziB
InChI InChI=1S/C16H16O2/c1-13-7-10-15(11-8-13)18-16(17)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3
InChIKey CXBNNSQNNIVMFA-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JDUpSvng7y9
Name 4-Methylphenyl .beta.-phenylpropionate
Alternate Name(s) (4-methylphenyl) 3-phenylpropanoate 3-Phenylpropanoic acid (4-methylphenyl) ester 3-Phenylpropionic acid p-tolyl ester p-Tolyl 3-phenylpropanoate
CAS Registry Number 22020-95-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-13-7-10-15(11-8-13)18-16(17)12-9-14-5-3-2-4-6-14/h2-8,10-11H,9,12H2,1H3
InChIKey CXBNNSQNNIVMFA-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES C(Oc1ccc(cc1)C)(=O)CCc1ccccc1
SPLASH splash10-0a4i-7900000000-d48b190bb2a72e15a2eb
Source of Spectrum NW-1704-0-0
Wiley ID 1243504