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Methyl (E)-9,9-(ethylenedioxy)-3-hydroxy-6-isopropyl-3-methyldec-4-enoate
SpectraBase Compound ID 5gRnmZdguuB
InChI InChI=1S/C17H30O5/c1-13(2)14(7-9-17(4)21-10-11-22-17)6-8-16(3,19)12-15(18)20-5/h6,8,13-14,19H,7,9-12H2,1-5H3/b8-6+
InChIKey KHMMOXRTJJDMNA-SOFGYWHQSA-N
Mol Weight 314.42 g/mol
Molecular Formula C17H30O5
Exact Mass 314.209324 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8im4ZJd16uy
Name Methyl (E)-9,9-(ethylenedioxy)-3-hydroxy-6-isopropyl-3-methyldec-4-enoate
Alternate Name(s) Methyl (4E)-3-hydroxy-3,7-dimethyl-6-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]-4-octenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H30O5
InChI InChI=1S/C17H30O5/c1-13(2)14(7-9-17(4)21-10-11-22-17)6-8-16(3,19)12-15(18)20-5/h6,8,13-14,19H,7,9-12H2,1-5H3/b8-6+
InChIKey KHMMOXRTJJDMNA-SOFGYWHQSA-N
Molecular Weight 314.422 g/mol
SMILES OC(CC(=O)OC)(\C=C\C(CCC1(OCCO1)C)C(C)C)C
SPLASH splash10-000i-9000000000-1dc89a05e4c87d76b353
Source of Spectrum SB-44-509-14
Wiley ID 744576