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7-Cyanomethylspiro[4.4]nonan-2-one diastereomer
SpectraBase Compound ID LSuJdsTVl3h
InChI InChI=1S/C11H15NO/c12-6-3-9-1-4-11(7-9)5-2-10(13)8-11/h9H,1-5,7-8H2
InChIKey KMKJAQMCYNVUHS-UHFFFAOYSA-N
Mol Weight 177.25 g/mol
Molecular Formula C11H15NO
Exact Mass 177.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3HRmcJcr2G
Name 7-Cyanomethylspiro[4.4]nonan-2-one diastereomer
Alternate Name(s) 7-Cyanomethylspiro[4.4]nonan-2-one (7-oxospiro[4.4]non-2-yl)acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO
InChI InChI=1S/C11H15NO/c12-6-3-9-1-4-11(7-9)5-2-10(13)8-11/h9H,1-5,7-8H2
InChIKey KMKJAQMCYNVUHS-UHFFFAOYSA-N
Molecular Weight 177.247 g/mol
SMILES C1C(CCC11CC(CC1)CC#N)=O
SPLASH splash10-001i-9500000000-c8dbee32339192cba741
Source of Spectrum AT-41-9869-23
Wiley ID 854942