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5-(2-phenylbutyryl)-2,3-cresotic acid

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5-(2-phenylbutyryl)-2,3-cresotic acid
SpectraBase Compound ID 1elh5fkO2Ot
InChI InChI=1S/C18H18O4/c1-3-14(12-7-5-4-6-8-12)17(20)13-9-11(2)16(19)15(10-13)18(21)22/h4-10,14,19H,3H2,1-2H3,(H,21,22)
InChIKey GQUAGNLRQXBIPW-UHFFFAOYSA-N
Mol Weight 298.34 g/mol
Molecular Formula C18H18O4
Exact Mass 298.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1sOlr5VoThB
Name 5-(2-PHENYLBUTYRYL)-2,3-CRESOTIC ACID
Source of Sample H. Cousse & G. Mouzin, Research Center Pierre Fabre Sa, Castres, France
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O4
InChI InChI=1S/C18H18O4/c1-3-14(12-7-5-4-6-8-12)17(20)13-9-11(2)16(19)15(10-13)18(21)22/h4-10,14,19H,3H2,1-2H3,(H,21,22)
InChIKey GQUAGNLRQXBIPW-UHFFFAOYSA-N
Melting Point 166C
Molecular Weight 298.34
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2,3-CRESOTIC ACID, 5-/2-PHENYLBUTYRYL/-,