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1-Naphthalenepentanoic acid, 6-(acetyloxy)decahydro-2-hydroxy-.beta.,2,5,5,8a-pentamethyl-, methyl ester, [1S-[1.alpha.(S*),2.beta.,4a.beta.,6.alpha.,8a.alpha.]]-
SpectraBase Compound ID Fw0lJ8dKeti
InChI InChI=1S/C23H40O5/c1-15(14-20(25)27-7)8-9-18-22(5)12-11-19(28-16(2)24)21(3,4)17(22)10-13-23(18,6)26/h15,17-19,26H,8-14H2,1-7H3
InChIKey FMRMLCJKHKKWNB-UHFFFAOYSA-N
Mol Weight 396.6 g/mol
Molecular Formula C23H40O5
Exact Mass 396.287574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KxyaQFfqWsp
Name 1-Naphthalenepentanoic acid, 6-(acetyloxy)decahydro-2-hydroxy-.beta.,2,5,5,8A-pentamethyl-, methyl ester, [1S-[1.alpha.(S*),2.beta.,4A.beta.,6.alpha.,8A.alpha.]]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 396.287574383 u
Formula C23H40O5
InChI InChI=1S/C23H40O5/c1-15(14-20(25)27-7)8-9-18-22(5)12-11-19(28-16(2)24)21(3,4)17(22)10-13-23(18,6)26/h15,17-19,26H,8-14H2,1-7H3
InChIKey FMRMLCJKHKKWNB-UHFFFAOYSA-N
Molecular Weight 396.568 g/mol
SMILES C12(C)C(C(C)(C)C(CC2)OC(C)=O)CCC(C1CCC(CC(OC)=O)C)(C)O