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1,3-Dioxolane-4-ethanol, alpha,2,2-trimethyl-5-[(phenylmethoxy)methyl]-, acetate, [4R-[4alpha(R*),5beta]]-
SpectraBase Compound ID GN1P3rdOTv2
InChI InChI=1S/C18H26O5/c1-13(21-14(2)19)10-16-17(23-18(3,4)22-16)12-20-11-15-8-6-5-7-9-15/h5-9,13,16-17H,10-12H2,1-4H3
InChIKey MMEIEWARHZLJKL-UHFFFAOYSA-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 4kDa0YHaFF6
Name 1,3-Dioxolane-4-ethanol, .alpha.,2,2-trimethyl-5-[(phenylmethoxy)methyl]-, acetate, [4R-[4.alpha.(R*),5.beta.]]-
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/c1-13(21-14(2)19)10-16-17(23-18(3,4)22-16)12-20-11-15-8-6-5-7-9-15/h5-9,13,16-17H,10-12H2,1-4H3
InChIKey MMEIEWARHZLJKL-UHFFFAOYSA-N
Molecular Weight 322.401 g/mol
SMILES CC1(C)OC(CC(C)OC(=O)C)C(O1)COCC=1C=CC=CC1