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Propanoic acid, 2-methyl-, dodecahydro-6,7-dihydroxy-3,6,10-trimethyl-2,9-dioxocyclodeca[b]furan -4-yl ester
SpectraBase Compound ID JVwrM4kblGH
InChI InChI=1S/C19H30O7/c1-9(2)17(22)26-14-8-19(5,24)15(21)7-12(20)10(3)6-13-16(14)11(4)18(23)25-13/h9-11,13-16,21,24H,6-8H2,1-5H3
InChIKey RRIMLOBVOWYQIW-UHFFFAOYSA-N
Mol Weight 370.44 g/mol
Molecular Formula C19H30O7
Exact Mass 370.199153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9bVXjJ1LKJg
Name Propanoic acid, 2-methyl-, dodecahydro-6,7-dihydroxy-3,6,10-trimethyl-2,9-dioxocyclodeca[B]furan -4-yl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.199153299 u
Formula C19H30O7
InChI InChI=1S/C19H30O7/c1-9(2)17(22)26-14-8-19(5,24)15(21)7-12(20)10(3)6-13-16(14)11(4)18(23)25-13/h9-11,13-16,21,24H,6-8H2,1-5H3
InChIKey RRIMLOBVOWYQIW-UHFFFAOYSA-N
Molecular Weight 370.442 g/mol
SMILES C1(OC2CC(C(CC(C(CC(C2C1C)OC(=O)C(C)C)(O)C)O)=O)C)=O