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Phenyl-acetic acid, (3,3-dimethyl-1-butynyl) ester

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Phenyl-acetic acid, (3,3-dimethyl-1-butynyl) ester
SpectraBase Compound ID LXbFBmpOrDL
InChI InChI=1S/C14H16O2/c1-14(2,3)9-10-16-13(15)11-12-7-5-4-6-8-12/h4-8H,11H2,1-3H3
InChIKey DOZGOOFVYOTRTB-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OQOW7iKuui
Name Phenyl-acetic acid, (3,3-dimethyl-1-butynyl) ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-14(2,3)9-10-16-13(15)11-12-7-5-4-6-8-12/h4-8H,11H2,1-3H3
InChIKey DOZGOOFVYOTRTB-UHFFFAOYSA-N
Instrument Name Varian XL-300
Literature Reference P.J. Stang, M. Boeshar, H. Wingert, J. Am. Chem. Soc. 110, 3272 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3