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Methyl 4,6-diethyl-3,6-epi-dioxydodeca-4-enoate
SpectraBase Compound ID 9UrjMLINx5P
InChI InChI=1S/C17H30O4/c1-5-8-9-10-11-17(7-3)13-14(6-2)15(20-21-17)12-16(18)19-4/h13,15H,5-12H2,1-4H3/t15-,17+/m1/s1
InChIKey DVGHMGSERXEMNQ-WBVHZDCISA-N
Mol Weight 298.42 g/mol
Molecular Formula C17H30O4
Exact Mass 298.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2CTZidWLxo
Name Methyl 4,6-diethyl-3,6-epi-dioxydodeca-4-enoate
Alternate Name(s) 2-[(3R,6S)-4,6-diethyl-6-hexyl-3H-1,2-dioxin-3-yl]acetic acid methyl ester Methyl 2-[(3R,6S)-4,6-diethyl-6-hexyl-3H-1,2-dioxin-3-yl]acetate Methyl 2-[(3R,6S)-4,6-diethyl-6-hexyl-3H-1,2-dioxin-3-yl]ethanoate
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Formula C17H30O4
InChI InChI=1S/C17H30O4/c1-5-8-9-10-11-17(7-3)13-14(6-2)15(20-21-17)12-16(18)19-4/h13,15H,5-12H2,1-4H3/t15-,17+/m1/s1
InChIKey DVGHMGSERXEMNQ-WBVHZDCISA-N
Molecular Weight 298.423 g/mol
SMILES C=1([C@](OO[C@@](C1)(CC)CCCCCC)(CC(=O)OC)[H])CC
SPLASH splash10-004s-0910000000-c8b4276f261c68b5a0ec
Source of Spectrum X2-68-761-3
Wiley ID 1609577