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1,3,5,7-Tetroxocane, 2,4,6,8-tetramethyl
SpectraBase Compound ID FSWZMMEEo5G
InChI InChI=1S/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3
InChIKey GKKDCARASOJPNG-UHFFFAOYSA-N
Mol Weight 176.21 g/mol
Molecular Formula C8H16O4
Exact Mass 176.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7LpeAxxVkg8
Name Metaldehyde isomer II
Source of Sample Sigma-Aldrich Cat. #36611
CAS Registry Number 108-62-3
Classification Pesticides: Molluscicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 176.104858991 u
Formula C8H16O4
InChI InChI=1S/C8H16O4/c1-5-9-6(2)11-8(4)12-7(3)10-5/h5-8H,1-4H3
InChIKey GKKDCARASOJPNG-UHFFFAOYSA-N
Molecular Weight 176.212 g/mol
Number of Peaks 41
RI1 1000
SMILES C1(OC(OC(OC(O1)C)C)C)C
SPLASH splash10-0002-9000000000-241406e0e6594cd24e37
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,3,5,7-Tetroxocane, 2,4,6,8-tetramethyl
Wiley ID LM_PEST_1180