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(2S,4R,6S,9R)-4-Allyl-9-benzyloxy-2-(2-(phenyl)ethyl)-1,7-dioxaspiro-[5.5]undecan-4-ol
SpectraBase Compound ID 3sJrOX8LbKF
InChI InChI=1S/C27H34O4/c1-2-16-26(28)18-24(14-13-22-9-5-3-6-10-22)31-27(21-26)17-15-25(20-30-27)29-19-23-11-7-4-8-12-23/h2-12,24-25,28H,1,13-21H2/t24-,25+,26+,27-/m0/s1
InChIKey KHULWKXAMCSKFE-YAOOYPAMSA-N
Mol Weight 422.6 g/mol
Molecular Formula C27H34O4
Exact Mass 422.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EmCqbWLKmBH
Name (2S,4R,6S,9R)-4-Allyl-9-benzyloxy-2-(2-(phenyl)ethyl)-1,7-dioxaspiro-[5.5]undecan-4-ol
Alternate Name(s) (2S,4R,6S,9R)-4-allyl-9-(benzyloxy)-2-phenethyl-1,7-dioxaspiro[5.5]undecan-4-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H34O4
InChI InChI=1S/C27H34O4/c1-2-16-26(28)18-24(14-13-22-9-5-3-6-10-22)31-27(21-26)17-15-25(20-30-27)29-19-23-11-7-4-8-12-23/h2-12,24-25,28H,1,13-21H2/t24-,25+,26+,27-/m0/s1
InChIKey KHULWKXAMCSKFE-YAOOYPAMSA-N
Literature Reference DOI 10.1002/adsc.200800154
Molecular Weight 422.565 g/mol
SMILES O[C@@]1(CC=C)C[C@@]2(OC[C@](OCc3ccccc3)(CC2)[H])O[C@@](CCc2ccccc2)(C1)[H]
SPLASH splash10-0006-9212000000-52c6b609829eebb9a3b4
Source of Spectrum ASC-350-1736/SM121-120_2
Wiley ID 1767983