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2-Acetoxymethyl-8-pentyl-oxocane
SpectraBase Compound ID 32eQuI9Xwq9
InChI InChI=1S/C15H28O3/c1-3-4-6-9-14-10-7-5-8-11-15(18-14)12-17-13(2)16/h14-15H,3-12H2,1-2H3
InChIKey CRRXHAUFUTXIFK-UHFFFAOYSA-N
Mol Weight 256.39 g/mol
Molecular Formula C15H28O3
Exact Mass 256.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eliojo07Cyu
Name 2-(hydroxymethyl)-8-pentyloxocane acetate
CAS Registry Number 115482-24-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O3
InChI InChI=1S/C15H28O3/c1-3-4-6-9-14-10-7-5-8-11-15(18-14)12-17-13(2)16/h14-15H,3-12H2,1-2H3
InChIKey CRRXHAUFUTXIFK-UHFFFAOYSA-N
Molecular Weight 256.386 g/mol
SMILES C1(OC(CCCCC1)CCCCC)COC(=O)C
SPLASH splash10-001i-4900000000-b7dff27b5c1675482edb
Source of Spectrum C-110-6215-9
Synonyms (8-pentyl-2-oxocanyl)methyl acetate
Wiley ID 1259965