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1,4-Dioxaspiro[4.5]decane-2-carbonitrile, 3-methyl-, (2S-trans)-
SpectraBase Compound ID KWbMzsHQURW
InChI InChI=1S/C10H15NO2/c1-8-9(7-11)13-10(12-8)5-3-2-4-6-10/h8-9H,2-6H2,1H3/t8-,9-/m0/s1
InChIKey QMUKTUKBGTUVJV-IUCAKERBSA-N
Mol Weight 181.23 g/mol
Molecular Formula C10H15NO2
Exact Mass 181.110279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7noV1ZWO2vi
Name 1,4-Dioxaspiro[4.5]decane-2-carbonitrile, 3-methyl-, (2S-trans)-
CAS Registry Number 90458-03-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-8-9(7-11)13-10(12-8)5-3-2-4-6-10/h8-9H,2-6H2,1H3/t8-,9-/m0/s1
InChIKey QMUKTUKBGTUVJV-IUCAKERBSA-N
Molecular Weight 181.235 g/mol
SMILES C12(O[C@@](C#N)([C@@](O2)(C)[H])[H])CCCCC1
SPLASH splash10-000i-3900000000-0d1c503ecb294153be51
Source of Spectrum AJ-60-2133-10
Synonyms (2S,3S)-2,3-(cyclohexylidenedioxy)butanenitrile (2S,3S)-3-methyl-1,4-dioxaspiro[4.5]decane-2-carbonitrile
Wiley ID 1177523