For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,5-Dimethyl-orsellinic acid, ethyl ester
SpectraBase Compound ID Dq84YRvGjRj
InChI InChI=1S/C12H16O4/c1-5-16-12(15)9-6(2)7(3)10(13)8(4)11(9)14/h13-14H,5H2,1-4H3
InChIKey NHKFCDQZJNYGKZ-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID G1sFtl2uefy
Name 3,5-Dimethyl-orsellinic acid, ethyl ester
CAS Registry Number 81345-10-0
Comments 100 MHZ SPECTRUM OF MIXTURE WITH 13C,18O LABELED COMPOUND, REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-5-16-12(15)9-6(2)7(3)10(13)8(4)11(9)14/h13-14H,5H2,1-4H3
InChIKey NHKFCDQZJNYGKZ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference S.A. Ahmed, F.E. Scott, T.J. Simpson, J. Chem. Soc. Perkin I 807 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3