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(2S,6S,9S)-2-Ethyl-9-methoxy-1,7-dioxaspiro[5.5]undecan-4-one
SpectraBase Compound ID 4fKRCEnjINS
InChI InChI=1S/C12H20O4/c1-3-10-6-9(13)7-12(16-10)5-4-11(14-2)8-15-12/h10-11H,3-8H2,1-2H3/t10-,11-,12-/m0/s1
InChIKey ITYXVGUJDMYESC-SRVKXCTJSA-N
Mol Weight 228.29 g/mol
Molecular Formula C12H20O4
Exact Mass 228.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3KX11D89s7L
Name (2S,6S,9S)-2-Ethyl-9-methoxy-1,7-dioxaspiro[5.5]undecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20O4
InChI InChI=1S/C12H20O4/c1-3-10-6-9(13)7-12(16-10)5-4-11(14-2)8-15-12/h10-11H,3-8H2,1-2H3/t10-,11-,12-/m0/s1
InChIKey ITYXVGUJDMYESC-SRVKXCTJSA-N
Literature Reference DOI 10.1002/adsc.200800154
Molecular Weight 228.288 g/mol
SMILES [C@@]12(CC[C@@](CO2)(OC)[H])CC(C[C@@](O1)(CC)[H])=O
SPLASH splash10-0007-3900000000-cd7796ee36c72710ac7d
Source of Spectrum ASC-350-1736/SM102-102_1
Wiley ID 1767943