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2-(5-carbomethoxy-2-hydroxy-3-oxopentyl)-8-pentyloxocane
SpectraBase Compound ID 8gGBJpKqVa7
InChI InChI=1S/C19H34O5/c1-3-4-6-9-15-10-7-5-8-11-16(24-15)14-18(21)17(20)12-13-19(22)23-2/h15-16,18,21H,3-14H2,1-2H3
InChIKey JEEWNFJIEKDBJB-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C19H34O5
Exact Mass 342.240624 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71JyxV3zyNF
Name 2-(5-carbomethoxy-2-hydroxy-3-oxopentyl)-8-pentyloxocane
Alternate Name(s) Methyl 5-hydroxy-4-oxo-6-(8-pentyl-2-oxocanyl)hexanoate
CAS Registry Number 115482-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H34O5
InChI InChI=1S/C19H34O5/c1-3-4-6-9-15-10-7-5-8-11-16(24-15)14-18(21)17(20)12-13-19(22)23-2/h15-16,18,21H,3-14H2,1-2H3
InChIKey JEEWNFJIEKDBJB-UHFFFAOYSA-N
Molecular Weight 342.476 g/mol
SMILES OC(C(=O)CCC(=O)OC)CC1OC(CCCCC)CCCCC1
SPLASH splash10-000i-6900000000-5628299a02e737aa6db5
Source of Spectrum C-110-6215-19
Wiley ID 1336585