4,6-Di-n-Butyl-3,5,7-trioxapentacyclo[7.2.1.0(2,8).0(4,11).0(6,10)]dodecane

SpectraBase Compound ID	EDSH6l6On88
InChI	InChI=1S/C17H26O3/c1-3-5-7-16-12-10-9-11-13(12)17(20-16,8-6-4-2)19-15(11)14(10)18-16/h10-15H,3-9H2,1-2H3/t10-,11+,12+,13-,14-,15+,16-,17+
InChIKey	SETYHYCZBSJOHS-CSSKBABPSA-N Google Search
Mol Weight	278.39 g/mol
Molecular Formula	C17H26O3
Exact Mass	278.188195 g/mol

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SpectraBase Spectrum ID	2toFsndDy8Y
Name	4,6-Di-n-Butyl-3,5,7-trioxapentacyclo[7.2.1.0(2,8).0(4,11).0(6,10)]dodecane
Alternate Name(s)	1,10-dibutyl-9,11,12-trioxapentacyclo[5.4.1.0(2,6).0(3,10).0(4,8)]dodecane
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H26O3
InChI	InChI=1S/C17H26O3/c1-3-5-7-16-12-10-9-11-13(12)17(20-16,8-6-4-2)19-15(11)14(10)18-16/h10-15H,3-9H2,1-2H3/t10-,11+,12+,13-,14-,15+,16-,17+
InChIKey	SETYHYCZBSJOHS-CSSKBABPSA-N
Molecular Weight	278.392 g/mol
SMILES	[C@@]12([C@]3([C@@]4([C@]5(C[C@@]3([C@](O1)([C@@]5(O[C@@]4(O2)CCCC)[H])[H])[H])[H])[H])[H])CCCC
SPLASH	splash10-000i-9020000000-2188ea21b716d4701c77
Source of Spectrum	F-56-347-16
Wiley ID	855580