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1,4-PENTALENEDIOL, OCTAHYDRO-, DIACETATE, (1alpha,3Aalpha,4alpha,6Aalpha)-
SpectraBase Compound ID IhBuhU0JDUT
InChI InChI=1S/C12H18O4/c1-7(13)15-11-5-3-10-9(11)4-6-12(10)16-8(2)14/h9-12H,3-6H2,1-2H3
InChIKey HYVIARUUVHVLHF-UHFFFAOYSA-N
Mol Weight 226.27 g/mol
Molecular Formula C12H18O4
Exact Mass 226.120509 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HfBkmMUnXaq
Name 1,4-PENTALENEDIOL, OCTAHYDRO-, DIACETATE, (1alpha,3Aalpha,4alpha,6Aalpha)-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H18O4
InChI InChI=1S/C12H18O4/c1-7(13)15-11-5-3-10-9(11)4-6-12(10)16-8(2)14/h9-12H,3-6H2,1-2H3
InChIKey HYVIARUUVHVLHF-UHFFFAOYSA-N
Molecular Weight 226.1200
SMILES C12C(CCC2OC(C)=O)C(OC(C)=O)CC1
SPLASH splash10-0a4l-9400000000-ce36b2dbbd6ff211e221
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany