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(4aS,8aS)-1-(2-methoxy-1,2-dioxoethyl)-5,5,8a-trimethyl-3,4,4a,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
SpectraBase Compound ID DM4Kj4QAbjt
InChI InChI=1S/C18H26O5/c1-17(2)9-6-10-18(3)12(17)8-7-11(15(20)22-4)13(18)14(19)16(21)23-5/h12H,6-10H2,1-5H3/t12-,18-/m0/s1
InChIKey IQANRMRNJHVTET-SGTLLEGYSA-N
Mol Weight 322.4 g/mol
Molecular Formula C18H26O5
Exact Mass 322.178024 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LMsX2oY5ubs
Name (4as,8as)-1-(2-Methoxy-1,2-dioxoethyl)-5,5,8A-trimethyl-3,4,4A,6,7,8-hexahydronaphthalene-2-carboxylic acid methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.178023932 u
Formula C18H26O5
InChI InChI=1S/C18H26O5/c1-17(2)9-6-10-18(3)12(17)8-7-11(15(20)22-4)13(18)14(19)16(21)23-5/h12H,6-10H2,1-5H3/t12-,18-/m0/s1
InChIKey IQANRMRNJHVTET-SGTLLEGYSA-N
Molecular Weight 322.401 g/mol
SMILES C=1([C@@]2([C@@](C(C)(C)CCC2)([H])CCC1C(=O)OC)C)C(C(=O)OC)=O