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(S)-(1'-Methylbutyl) (E)-2,4-dimethyl-2-pentenoate
SpectraBase Compound ID 8Dw1ShHbE3d
InChI InChI=1S/C12H22O2/c1-6-7-11(5)14-12(13)10(4)8-9(2)3/h8-9,11H,6-7H2,1-5H3/b10-8+/t11-/m0/s1
InChIKey FSYDYWBQQJBBIE-UQSGXBNBSA-N
Mol Weight 198.31 g/mol
Molecular Formula C12H22O2
Exact Mass 198.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6tAcLo9c2aD
Name (S)-(1'-Methylbutyl) (E)-2,4-dimethyl-2-pentenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-6-7-11(5)14-12(13)10(4)8-9(2)3/h8-9,11H,6-7H2,1-5H3/b10-8+/t11-/m0/s1
InChIKey FSYDYWBQQJBBIE-UQSGXBNBSA-N
Molecular Weight 198.306 g/mol
SMILES C(\C(=C\C(C)C)C)(O[C@](CCC)(C)[H])=O
SPLASH splash10-054o-9400000000-2ce31a1cfaa88c7c281d
Source of Spectrum SK-22-612-10
Synonyms (1S)-1-methylbutyl (2E)-2,4-dimethyl-2-pentenoate (E)-2,4-dimethyl-2-pentenoic acid[(2S)-pentan-2-yl]ester (E)-2,4-dimethylpent-2-enoic acid[(1S)-1-methylbutyl]ester [(1S)-1-methylbutyl](E)-2,4-dimethylpent-2-enoate [(2S)-pentan-2-yl](E)-2,4-dimethylpent-2-enoate (E)-2,4-dimethyl-2-pentenoic acid [(2S)-pentan-2-yl] ester [(1S)-1-methylbutyl] (E)-2,4-dimethylpent-2-enoate [(2S)-pentan-2-yl] (E)-2,4-dimethylpent-2-enoate
Wiley ID 851984