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4-[(1S,2R)-3,3-Dimethyl-2-(3,3-ethylenedioxybutyl)cyclobutyl]pent-4-enitrile
SpectraBase Compound ID 63BREahC8vk
InChI InChI=1S/C17H27NO2/c1-13(6-5-9-18)14-12-16(2,3)15(14)7-8-17(4)19-10-11-20-17/h14-15H,1,5-8,10-12H2,2-4H3/t14-,15-/m1/s1
InChIKey OVLWLPZNIJDORX-HUUCEWRRSA-N
Mol Weight 277.41 g/mol
Molecular Formula C17H27NO2
Exact Mass 277.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3bVdiT9ak4
Name 4-[(1S,2R)-3,3-Dimethyl-2-(3,3-ethylenedioxybutyl)cyclobutyl]pent-4-enitrile
Alternate Name(s) 4-[(1S,2R)-3,3-dimethyl-2-[2-(2-methyl-1,3-dioxolan-2-yl)ethyl]cyclobutyl]-4-pentenenitrile
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Formula C17H27NO2
InChI InChI=1S/C17H27NO2/c1-13(6-5-9-18)14-12-16(2,3)15(14)7-8-17(4)19-10-11-20-17/h14-15H,1,5-8,10-12H2,2-4H3/t14-,15-/m1/s1
InChIKey OVLWLPZNIJDORX-HUUCEWRRSA-N
Molecular Weight 277.408 g/mol
SMILES [C@@]1([C@](CCC2(OCCO2)C)([H])C(C1)(C)C)(C(=C)CCC#N)[H]
SPLASH splash10-0abl-6920000000-1ab8cdf3ec4743ed15b1
Source of Spectrum SO-0-1154-11
Wiley ID 877958