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2-NAPHTHALENEACETIC ACID, 1,2,3,4,4A,7-HEXAHYDRO-3-HYDROXY-.ALPHA.,4A,8-TRIMETHYL-7-OXO-METHYL ESTER

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2-NAPHTHALENEACETIC ACID, 1,2,3,4,4A,7-HEXAHYDRO-3-HYDROXY-.ALPHA.,4A,8-TRIMETHYL-7-OXO-METHYL ESTER
SpectraBase Compound ID 478bQn53kPY
InChI InChI=1S/C16H22O4/c1-9(15(19)20-4)11-7-12-10(2)13(17)5-6-16(12,3)8-14(11)18/h5-6,9,11,14,18H,7-8H2,1-4H3
InChIKey LJVZKPOZZPXFHZ-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C16H22O4
Exact Mass 278.151809 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6QUgGYcX0Rj
Name (11S)-3-Oxo-8a-hydroxy-7aH-eudesma-1,4-dien-12-oic acid, methyl ester
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H22O4
InChI InChI=1S/C16H22O4/c1-9(15(19)20-4)11-7-12-10(2)13(17)5-6-16(12,3)8-14(11)18/h5-6,9,11,14,18H,7-8H2,1-4H3
InChIKey LJVZKPOZZPXFHZ-UHFFFAOYSA-N
Instrument Name Bruker AM-200
Literature Reference J.A. Marco, M. Carda, Magn. Res. Chem. 25, 1087 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3