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1,8-OCTANDIOIC ACID, 3,5-DIMETHYL-, DIMETHYL ESTER
SpectraBase Compound ID IQgx1NYfvKo
InChI InChI=1S/C12H22O4/c1-9(5-6-11(13)15-3)7-10(2)8-12(14)16-4/h9-10H,5-8H2,1-4H3
InChIKey VCZUOUHHGRZBNV-UHFFFAOYSA-N
Mol Weight 230.3 g/mol
Molecular Formula C12H22O4
Exact Mass 230.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4SRLQJjZWkP
Name 1,8-OCTANDIOIC ACID, 3,5-DIMETHYL-, DIMETHYL ESTER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H22O4
InChI InChI=1S/C12H22O4/c1-9(5-6-11(13)15-3)7-10(2)8-12(14)16-4/h9-10H,5-8H2,1-4H3
InChIKey VCZUOUHHGRZBNV-UHFFFAOYSA-N
Molecular Weight 230.1512
SMILES COC(CC(C)CC(C)CCC(=O)OC)=O
SPLASH splash10-0a59-9500000000-15ff80fa065dd9f41c5d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany