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(1R,2R,3S)-2-((Z)-2-Penten-1-yl)-3-((phenylselenyl)methyl)cyclopentyl Acetate
SpectraBase Compound ID 4ajjP1G7LgY
InChI InChI=1S/C19H26O2Se/c1-3-4-6-11-18-16(12-13-19(18)21-15(2)20)14-22-17-9-7-5-8-10-17/h4-10,16,18-19H,3,11-14H2,1-2H3/b6-4-/t16-,18-,19-/m1/s1
InChIKey CKFRYXWTIYBEIL-PXTCIDSZSA-N
Mol Weight 365.39 g/mol
Molecular Formula C19H26O2Se
Exact Mass 366.109802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BjBPQio66hJ
Name (1R,2R,3S)-2-((Z)-2-Penten-1-yl)-3-((phenylselenyl)methyl)cyclopentyl Acetate
Appearance Yellowish oil
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Formula C19H26O2Se
InChI InChI=1S/C19H26O2Se/c1-3-4-6-11-18-16(12-13-19(18)21-15(2)20)14-22-17-9-7-5-8-10-17/h4-10,16,18-19H,3,11-14H2,1-2H3/b6-4-/t16-,18-,19-/m1/s1
InChIKey CKFRYXWTIYBEIL-PXTCIDSZSA-N
Instrument Name HP 6890/ MSD 5973 & HP 7890A/MSD 5975
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.1c00145
Molecular Weight 365.387 g/mol
SMILES [C@@]1([C@]([C@](OC(C)=O)(CC1)[H])(C\C=C/CC)[H])(C[Se]c1ccccc1)[H]
SPLASH splash10-0006-9401000000-205b7be257b9e94fb4fe
Source of Spectrum JOC-86-5252-15
Thin-Layer Chromatography Rf = 0.67 (pentane/diethyl ether, 2:1)
Wiley ID 1870187