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(5R)-3-[(1R)-1-Hydroxypropyl]-5-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-4-methylfuran-2(5H)-one

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(5R)-3-[(1R)-1-Hydroxypropyl]-5-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-4-methylfuran-2(5H)-one
SpectraBase Compound ID CWjMpfcmHbj
InChI InChI=1S/C18H30O4/c1-6-14(19)16-12(5)18(22-17(16)20)21-15-9-11(4)7-8-13(15)10(2)3/h10-11,13-15,18-19H,6-9H2,1-5H3/t11-,13+,14-,15-,18-/m1/s1
InChIKey MONFVFYITITCBP-CBOACHJZSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L26Yb3Sjl4H
Name (5R)-3-[(1R)-1-Hydroxypropyl]-5-{[(1R,2S,5R)-2-isopropyl-5-methylcyclohexyl]oxy}-4-methylfuran-2(5H)-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.214409442 u
Formula C18H30O4
InChI InChI=1S/C18H30O4/c1-6-14(19)16-12(5)18(22-17(16)20)21-15-9-11(4)7-8-13(15)10(2)3/h10-11,13-15,18-19H,6-9H2,1-5H3/t11-,13+,14-,15-,18-/m1/s1
InChIKey MONFVFYITITCBP-CBOACHJZSA-N
SMILES C=1(C(O[C@](C1C)(O[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])[H])[H])=O)[C@](O)(CC)[H]