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(1R*,5R*,7S*)-1-Formyl-7-methyl-6-oxaspiro[4.5]dec-1-ylacetonitrile
SpectraBase Compound ID DquVJrAHkkp
InChI InChI=1S/C13H19NO2/c1-11-4-2-6-13(16-11)7-3-5-12(13,10-15)8-9-14/h10-11H,2-8H2,1H3/t11-,12-,13-/m1/s1
InChIKey GZPJFAQOGRSXAI-JHJVBQTASA-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 7jLWajbYM0N
Name (1R*,5R*,7S*)-1-Formyl-7-methyl-6-oxaspiro[4.5]dec-1-ylacetonitrile
Alternate Name(s) 2-[(4S,5S,9R)-4-formyl-9-methyl-10-oxaspiro[4.5]decan-4-yl]acetonitrile 2-[(4S,5S,9R)-4-methanoyl-9-methyl-10-oxaspiro[4.5]decan-4-yl]ethanenitrile [(1S,5S,7R)-1-formyl-7-methyl-6-oxaspiro[4.5]dec-1-yl]acetonitrile 2-[(4S,5S,7R)-4-methanoyl-7-methyl-6-oxaspiro[4.5]decan-4-yl]ethanenitrile
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Formula C13H19NO2
InChI InChI=1S/C13H19NO2/c1-11-4-2-6-13(16-11)7-3-5-12(13,10-15)8-9-14/h10-11H,2-8H2,1H3/t11-,12-,13-/m1/s1
InChIKey GZPJFAQOGRSXAI-JHJVBQTASA-N
Molecular Weight 221.300 g/mol
SMILES [C@@]12([C@@](C=O)(CC#N)CCC2)O[C@](C)(CCC1)[H]
SPLASH splash10-08g1-6900000000-8f72fe0ae7522a101927
Source of Spectrum F2-43-1627-4
Wiley ID 1553127