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2-Oxocanemethanol, 8-ethyl-.alpha.-pentyl-, acetate
SpectraBase Compound ID IwTEQEMZZYi
InChI InChI=1S/C17H32O3/c1-4-6-8-12-16(19-14(3)18)17-13-10-7-9-11-15(5-2)20-17/h15-17H,4-13H2,1-3H3
InChIKey BFAHOCKAGNOUBY-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C17H32O3
Exact Mass 284.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1fTbtkw1jc
Name 2-Oxocanemethanol, 8-ethyl-.alpha.-pentyl-, acetate
Alternate Name(s) 1-(8-Ethyl-2-oxocanyl)hexyl acetate Octahydrodebromolaurencin
CAS Registry Number 55101-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H32O3
InChI InChI=1S/C17H32O3/c1-4-6-8-12-16(19-14(3)18)17-13-10-7-9-11-15(5-2)20-17/h15-17H,4-13H2,1-3H3
InChIKey BFAHOCKAGNOUBY-UHFFFAOYSA-N
Molecular Weight 284.440 g/mol
SMILES C1(OC(CCCCC1)CC)C(OC(=O)C)CCCCC
SPLASH splash10-0006-9800000000-e0ffb2aebcefd77ce768
Source of Spectrum T-68-3889-0
Wiley ID 41712