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Ethyl (2E)-(1-{(1R)-[2-(acetyloxy)ethyl]hexyl}-2-piperidinylidene)ethanoate
SpectraBase Compound ID DAhHO4giyT1
InChI InChI=1S/C19H33NO4/c1-4-6-7-10-17(12-14-24-16(3)21)20-13-9-8-11-18(20)15-19(22)23-5-2/h15,17H,4-14H2,1-3H3/b18-15+/t17-/m1/s1
InChIKey JLGLPAGMYWYTLZ-PQMNFKMDSA-N
Mol Weight 339.5 g/mol
Molecular Formula C19H33NO4
Exact Mass 339.240959 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4eZUrK6neS
Name Ethyl (2E)-(1-{(1R)-[2-(acetyloxy)ethyl]hexyl}-2-piperidinylidene)ethanoate
Appearance Pale yellow oil
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Formula C19H33NO4
InChI InChI=1S/C19H33NO4/c1-4-6-7-10-17(12-14-24-16(3)21)20-13-9-8-11-18(20)15-19(22)23-5-2/h15,17H,4-14H2,1-3H3/b18-15+/t17-/m1/s1
InChIKey JLGLPAGMYWYTLZ-PQMNFKMDSA-N
Instrument Name VG 70 SEQ
Ionization Type EI
Literature Reference DOI 10.1186/1860-5397-4-5
Molecular Weight 339.476 g/mol
Optical Rotation [a]D20 = +32.6 (c = 1.18, absolute EtOH)
SMILES [C@](N1\C(CCCC1)=C/C(=O)OCC)(CCCCC)(CCOC(C)=O)[H]
SPLASH splash10-0lk9-4691000000-de0289d9fcc73d17e430
Source of Spectrum BJO-4-SM11-38
Thin-Layer Chromatography Rf = 0.83 (hexane-EtOAc, 1:1)
Wiley ID 1871527