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butyric acid, p-tolyl ester
SpectraBase Compound ID JGXHT0bAq38
InChI InChI=1S/C11H14O2/c1-3-4-11(12)13-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3
InChIKey RRXBRABFDRJAPX-UHFFFAOYSA-N
Mol Weight 178.23 g/mol
Molecular Formula C11H14O2
Exact Mass 178.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oCx0fVz7SI
Name Butanoic acid, 4-methylphenyl ester
Alternate Name(s) 4-Methylphenyl butyrate (4-methylphenyl) butanoate Butyric acid p-tolyl ester p-Cresyl butanoate p-Cresyl n-butyrate p-Tolyl butanoate p-Tolyl butyrate AI3-18342 EINECS 238-654-6
CAS Registry Number 14617-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2
InChI InChI=1S/C11H14O2/c1-3-4-11(12)13-10-7-5-9(2)6-8-10/h5-8H,3-4H2,1-2H3
InChIKey RRXBRABFDRJAPX-UHFFFAOYSA-N
Molecular Weight 178.231 g/mol
SMILES C(=O)(Oc1ccc(cc1)C)CCC
SPLASH splash10-0a4i-8900000000-0cf31a4890d0da3b4be5
Wiley ID 1497476