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(.beta.-[3,4-(Methylenedioxy)-phenyl]-cyclohex-2-enyl)-acetic acid

View entire compound with spectra: 1 NMR

(.beta.-[3,4-(Methylenedioxy)-phenyl]-cyclohex-2-enyl)-acetic acid
SpectraBase Compound ID DVxotMMKpzb
InChI InChI=1S/C15H16O4/c16-14(17)9-15(6-2-1-3-7-15)11-4-5-12-13(8-11)19-10-18-12/h2,4-6,8H,1,3,7,9-10H2,(H,16,17)
InChIKey PTDFAJXEUITHOQ-UHFFFAOYSA-N
Mol Weight 260.29 g/mol
Molecular Formula C15H16O4
Exact Mass 260.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E1gqZ92r3Rb
Name (.beta.-[3,4-(Methylenedioxy)-phenyl]-cyclohex-2-enyl)-acetic acid
CAS Registry Number 82201-78-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H16O4
InChI InChI=1S/C15H16O4/c16-14(17)9-15(6-2-1-3-7-15)11-4-5-12-13(8-11)19-10-18-12/h2,4-6,8H,1,3,7,9-10H2,(H,16,17)
InChIKey PTDFAJXEUITHOQ-UHFFFAOYSA-N
Instrument Name Varian SC-300
Literature Reference G.E. Keck, R.R. Webb, J. Am. Chem. Soc. 103, 3173 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3