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1,9-Diisopropyl-3.beta.-hydroperoxy-7.alpha.-methoxy-2,8,12-trioxatetracyclo[7.2.1.0(.4,11)0.(6,10)]dodecane
SpectraBase Compound ID KxmHel6jCA0
InChI InChI=1S/C16H26O6/c1-7(2)15-11-9(13(18-5)19-15)6-10-12(11)16(22-15,8(3)4)20-14(10)21-17/h7-14,17H,6H2,1-5H3/t9?,10?,11?,12?,13-,14+,15?,16?/m1/s1
InChIKey QQMQVENWVCFSIV-SIYHDDFOSA-N
Mol Weight 314.38 g/mol
Molecular Formula C16H26O6
Exact Mass 314.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1gW2rySOn57
Name 1,9-Diisopropyl-3.beta.-hydroperoxy-7.alpha.-methoxy-2,8,12-trioxatetracyclo[7.2.1.0(.4,11)0.(6,10)]dodecane
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O6
InChI InChI=1S/C16H26O6/c1-7(2)15-11-9(13(18-5)19-15)6-10-12(11)16(22-15,8(3)4)20-14(10)21-17/h7-14,17H,6H2,1-5H3/t9?,10?,11?,12?,13-,14+,15?,16?/m1/s1
InChIKey QQMQVENWVCFSIV-SIYHDDFOSA-N
Molecular Weight 314.378 g/mol
SMILES OO[C@@]1(OC2(OC3(O[C@@](OC)(C4C3C2C1C4)[H])C(C)C)C(C)C)[H]
SPLASH splash10-0a4i-0090000000-728df7fa314f1f39601d
Source of Spectrum F-67-7240-6b
Wiley ID 1687681