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(2S,6S,8S)-2-(3-(Benzyloxy)propyl)-8-((Methoxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one
SpectraBase Compound ID 3eVjhu48Ctm
InChI InChI=1S/C21H30O5/c1-23-16-20-9-5-11-21(26-20)14-18(22)13-19(25-21)10-6-12-24-15-17-7-3-2-4-8-17/h2-4,7-8,19-20H,5-6,9-16H2,1H3/t19-,20-,21-/m0/s1
InChIKey WHHYKKAPGJATKG-ACRUOGEOSA-N
Mol Weight 362.47 g/mol
Molecular Formula C21H30O5
Exact Mass 362.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCpkWcm0UDu
Name (2S,6S,8S)-2-(3-(Benzyloxy)propyl)-8-((Methoxy)methyl)-1,7-dioxaspiro[5.5]undecan-4-one
Alternate Name(s) (2S,6S,8S)-2-(3-(benzyloxy)propyl)-8-(methoxymethyl)-1,7-dioxaspiro[5.5]undecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30O5
InChI InChI=1S/C21H30O5/c1-23-16-20-9-5-11-21(26-20)14-18(22)13-19(25-21)10-6-12-24-15-17-7-3-2-4-8-17/h2-4,7-8,19-20H,5-6,9-16H2,1H3/t19-,20-,21-/m0/s1
InChIKey WHHYKKAPGJATKG-ACRUOGEOSA-N
Literature Reference DOI 10.1002/adsc.200800154
Molecular Weight 362.466 g/mol
SMILES [C@@]12(O[C@@](CCC2)(COC)[H])CC(=O)C[C@@](O1)(CCCOCc1ccccc1)[H]
SPLASH splash10-0006-9100000000-658d2e988bca50fb20d3
Source of Spectrum ASC-350-1736/SM111-110_3
Wiley ID 1767958