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(E,4S)-4-hydroxy-4,8-dimethyl-2-nonenoic acid methyl ester
SpectraBase Compound ID Cui8HzPi1Kw
InChI InChI=1S/C12H22O3/c1-10(2)6-5-8-12(3,14)9-7-11(13)15-4/h7,9-10,14H,5-6,8H2,1-4H3/b9-7+/t12-/m0/s1
InChIKey PCANQZAJMRJSSE-CRALRDPISA-N
Mol Weight 214.3 g/mol
Molecular Formula C12H22O3
Exact Mass 214.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KzGVZwxTAwg
Name (E,4S)-4-hydroxy-4,8-dimethyl-2-nonenoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O3
InChI InChI=1S/C12H22O3/c1-10(2)6-5-8-12(3,14)9-7-11(13)15-4/h7,9-10,14H,5-6,8H2,1-4H3/b9-7+/t12-/m0/s1
InChIKey PCANQZAJMRJSSE-CRALRDPISA-N
Molecular Weight 214.305 g/mol
SMILES O[C@](\C=C\C(=O)OC)(CCCC(C)C)C
SPLASH splash10-05ot-9400000000-bb0c3646032dc81edb9a
Source of Spectrum J-59-4469-22
Synonyms (E,4S)-4-hydroxy-4,8-dimethyl-non-2-enoic acid methyl ester Methyl (E,4S)-4,8-dimethyl-4-oxidanyl-non-2-enoate Methyl (E,4S)-4-hydroxy-4,8-dimethyl-non-2-enoate
Wiley ID 1213656