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4H-1,3-BENZODIOXIN-4-ONE, 5-BUTYL-2-(1,1-DIMETHYLETHYL)HEXAHYDRO-4A-METHYL-, [2S-(2alpha,4Abeta,5beta,8Abeta)]-
SpectraBase Compound ID CRWKp8vz1wu
InChI InChI=1S/C13H22O3.C4H10/c1-3-4-6-10-7-5-8-11-13(10,2)12(14)16-9-15-11;1-4(2)3/h10-11H,3-9H2,1-2H3;4H,1-3H3
InChIKey VRPMOAPKFLXPFH-UHFFFAOYSA-N
Mol Weight 284.44 g/mol
Molecular Formula C17H32O3
Exact Mass 284.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GPGzRYhMGTJ
Name 4H-1,3-BENZODIOXIN-4-ONE, 5-BUTYL-2-(1,1-DIMETHYLETHYL)HEXAHYDRO-4A-METHYL-, [2S-(2alpha,4Abeta,5beta,8Abeta)]-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H30O3
InChI InChI=1S/C13H22O3.C4H10/c1-3-4-6-10-7-5-8-11-13(10,2)12(14)16-9-15-11;1-4(2)3/h10-11H,3-9H2,1-2H3;4H,1-3H3
InChIKey VRPMOAPKFLXPFH-UHFFFAOYSA-N
Molecular Weight 284.2343
SMILES C(C)(C)C.C1(=O)OCOC2CCCC(CCCC)C12C
SPLASH splash10-0f6t-9300000000-0a655b13e5e22423e0da
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany