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2(5H)-Furanone, 4-[2-[decahydro-7-hydroxy-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-1-naphthalenyl]ethyl]-, [1R-(1.alpha.,4a.beta.,5.beta.,7.beta.,8a.alpha.)]-
SpectraBase Compound ID t4HxczLGG4
InChI InChI=1S/C20H30O4/c1-13-4-7-17-19(2,12-21)9-15(22)10-20(17,3)16(13)6-5-14-8-18(23)24-11-14/h8,15-17,21-22H,1,4-7,9-12H2,2-3H3
InChIKey XSDUUAKXMAHWIG-UHFFFAOYSA-N
Mol Weight 334.46 g/mol
Molecular Formula C20H30O4
Exact Mass 334.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 84o1Lwq4n0I
Name 2(5H)-Furanone, 4-[2-[decahydro-7-hydroxy-5-(hydroxymethyl)-5,8A-dimethyl-2-methylene-1-naphthalenyl]ethyl]-, [1R-(1.alpha.,4A.beta.,5.beta.,7.beta.,8A.alpha.)]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.214409442 u
Formula C20H30O4
InChI InChI=1S/C20H30O4/c1-13-4-7-17-19(2,12-21)9-15(22)10-20(17,3)16(13)6-5-14-8-18(23)24-11-14/h8,15-17,21-22H,1,4-7,9-12H2,2-3H3
InChIKey XSDUUAKXMAHWIG-UHFFFAOYSA-N
Molecular Weight 334.456 g/mol
SMILES C12(C(C(CO)(C)CC(C2)O)CCC(C1CCC1=CC(=O)OC1)=C)C