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(2S,6S,8S)-2,8-Bis[(benzyloxy)methyl]-1,7-dioxaspiro[5.5]undecan-4-one
SpectraBase Compound ID 5q8GKCAN0i0
InChI InChI=1S/C25H30O5/c26-22-14-24(19-28-17-21-10-5-2-6-11-21)30-25(15-22)13-7-12-23(29-25)18-27-16-20-8-3-1-4-9-20/h1-6,8-11,23-24H,7,12-19H2/t23-,24-,25-/m0/s1
InChIKey UQWVBPNKDODVMT-SDHOMARFSA-N
Mol Weight 410.51 g/mol
Molecular Formula C25H30O5
Exact Mass 410.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYIrxMMLSfp
Name (2S,6S,8S)-2,8-Bis[(benzyloxy)methyl]-1,7-dioxaspiro[5.5]undecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H30O5
InChI InChI=1S/C25H30O5/c26-22-14-24(19-28-17-21-10-5-2-6-11-21)30-25(15-22)13-7-12-23(29-25)18-27-16-20-8-3-1-4-9-20/h1-6,8-11,23-24H,7,12-19H2/t23-,24-,25-/m0/s1
InChIKey UQWVBPNKDODVMT-SDHOMARFSA-N
Literature Reference DOI 10.1002/adsc.200800154
Molecular Weight 410.510 g/mol
SMILES [C@]12(O[C@@](CCC2)(COCc2ccccc2)[H])CC(C[C@@](COCc2ccccc2)(O1)[H])=O
SPLASH splash10-0006-9000000000-d553dd78683b0548f45f
Source of Spectrum ASC-350-1736/SM64-63_3
Synonyms (2S,6S,8S)-2,8-bis((benzyloxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one
Wiley ID 1768107