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Ethyl (E)-6,7-dihydrogeranate
SpectraBase Compound ID FKcJqG44Mei
InChI InChI=1S/C12H22O2/c1-5-14-12(13)9-11(4)8-6-7-10(2)3/h9-10H,5-8H2,1-4H3/b11-9+
InChIKey ZUEFKHXRQLTKCX-PKNBQFBNSA-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 HOnB7IScGMt
Name Ethyl (E)-6,7-dihydrogeranate
Appearance Colorless oil
Carrier Gas Helium
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Formula C12H22O2
InChI InChI=1S/C12H22O2/c1-5-14-12(13)9-11(4)8-6-7-10(2)3/h9-10H,5-8H2,1-4H3/b11-9+
InChIKey ZUEFKHXRQLTKCX-PKNBQFBNSA-N
Instrument Name Agilent 7890B-5977A
Ionization Type EI
Literature Reference DOI 10.1002/anie.202014180
Molecular Weight 198.306 g/mol
Reported Formula C12H22O2
SMILES C(CC\C(=C\C(OCC)=O)C)C(C)C
SPLASH splash10-0ftf-9600000000-af2f9522dea96c307e2f
Source of Spectrum ACI-60-SM50-S2a
Thin-Layer Chromatography Rf = 0.20 (cyclohexane/EtOAc, 50:1)
Wiley ID 1880485