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

*Links on SpectraBase are not permalinks.
APIOSPORIC_ACID;6-(HYDROXYMETHYL)-2-METHYL-1,2,4A,5,6,7,8,8A-OCTAHYDRO-1-NAPHTHALENECARBOXYLIC_ACID
SpectraBase Compound ID 9QBVlr89NTG
InChI InChI=1S/C13H20O3/c1-8-2-4-10-6-9(7-14)3-5-11(10)12(8)13(15)16/h2,4,8-12,14H,3,5-7H2,1H3,(H,15,16)/t8-,9-,10-,11-,12-/m1/s1
InChIKey LQQYYLGWHXPFKQ-LZQZFOIKSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 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 Aq6vC4Hd60e
Name APIOSPORIC_ACID;6-(HYDROXYMETHYL)-2-METHYL-1,2,4A,5,6,7,8,8A-OCTAHYDRO-1-NAPHTHALENECARBOXYLIC_ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-8-2-4-10-6-9(7-14)3-5-11(10)12(8)13(15)16/h2,4,8-12,14H,3,5-7H2,1H3,(H,15,16)/t8-,9-,10-,11-,12-/m1/s1
InChIKey LQQYYLGWHXPFKQ-LZQZFOIKSA-N
Literature Reference Author C.KLEMKE,S.KEHRAUS,A.D.WRIGHT,G.M.KOENIG
Literature Reference Citation J.NAT.PROD.,67,1058(2004)
Literature Reference DOI 10.1021/np034061x
Molecular Weight 224.300 g/mol
Solvent ACETONE-D6
Source File Reference UWMZ5823