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5-(2-Oxocyclopentyl)-2-pentenitrile Ethylene Ketal
SpectraBase Compound ID FUBKi41SCcp
InChI InChI=1S/C12H17NO2/c13-8-3-1-2-5-11-6-4-7-12(11)14-9-10-15-12/h1,3,11H,2,4-7,9-10H2/b3-1+
InChIKey LCEWOHVGBJZEGD-HNQUOIGGSA-N
Mol Weight 207.27 g/mol
Molecular Formula C12H17NO2
Exact Mass 207.125929 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B04AKaEQ4gq
Name 5-(2-Oxocyclopentyl)-2-pentenitrile Ethylene Ketal
Alternate Name(s) (2E)-5-(1,4-dioxaspiro[4.4]non-6-yl)-2-pentenenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO2
InChI InChI=1S/C12H17NO2/c13-8-3-1-2-5-11-6-4-7-12(11)14-9-10-15-12/h1,3,11H,2,4-7,9-10H2/b3-1+
InChIKey LCEWOHVGBJZEGD-HNQUOIGGSA-N
Molecular Weight 207.273 g/mol
SMILES C12(OCCO2)C(CCC1)CC\C=C\C#N
SPLASH splash10-0005-9600000000-1f26c5da3518c74971a6
Source of Spectrum J-59-1438-0
Wiley ID 1205895