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(1S*,5S*)-1-Acetyl-6-oxaspiro[4.5]dec-1-ylacetonitrile
SpectraBase Compound ID C3rqhfa1krc
InChI InChI=1S/C13H19NO2/c1-11(15)12(8-9-14)5-4-7-13(12)6-2-3-10-16-13/h2-8,10H2,1H3/t12-,13-/m1/s1
InChIKey ZZJDTRSOLOWQEP-CHWSQXEVSA-N
Mol Weight 221.3 g/mol
Molecular Formula C13H19NO2
Exact Mass 221.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAKp6LIpHnU
Name (1S*,5S*)-1-Acetyl-6-oxaspiro[4.5]dec-1-ylacetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11(15)12(8-9-14)5-4-7-13(12)6-2-3-10-16-13/h2-8,10H2,1H3/t12-,13-/m1/s1
InChIKey ZZJDTRSOLOWQEP-CHWSQXEVSA-N
Molecular Weight 221.300 g/mol
SMILES [C@]1([C@]2(OCCCC2)CCC1)(C(=O)C)CC#N
SPLASH splash10-03di-0910000000-8ab75a2dbec4fc5ea149
Source of Spectrum F2-43-1627-4
Synonyms (1R*,5R*)-1-Acetyl-6-oxaspiro[4.5]dec-1-ylacetonitrile 2-[(4S,5S)-4-acetyl-10-oxaspiro[4.5]decan-4-yl]acetonitrile 2-[(4S,5S)-4-ethanoyl-10-oxaspiro[4.5]decan-4-yl]ethanenitrile [(1S,5S)-1-acetyl-6-oxaspiro[4.5]dec-1-yl]acetonitrile 2-[(4S,5S)-4-ethanoyl-6-oxaspiro[4.5]decan-4-yl]ethanenitrile
Wiley ID 1553130