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{(1S,5R,6R)-3,3-Dimethyl-2,4-dioxabicyclo[3.3.0]octan-6-yl}acetonitrile
SpectraBase Compound ID GeSijqjrBve
InChI InChI=1S/C10H15NO2/c1-10(2)12-8-4-3-7(5-6-11)9(8)13-10/h7-9H,3-5H2,1-2H3/t7-,8+,9-/m1/s1
InChIKey HOYRTZPOJGFLSU-HRDYMLBCSA-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 DPeWbKqczHC
Name {(1S,5R,6R)-3,3-Dimethyl-2,4-dioxabicyclo[3.3.0]octan-6-yl}acetonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO2
InChI InChI=1S/C10H15NO2/c1-10(2)12-8-4-3-7(5-6-11)9(8)13-10/h7-9H,3-5H2,1-2H3/t7-,8+,9-/m1/s1
InChIKey HOYRTZPOJGFLSU-HRDYMLBCSA-N
Molecular Weight 181.235 g/mol
SMILES C1(O[C@@]2([C@@](CC#N)(CC[C@@]2(O1)[H])[H])[H])(C)C
SPLASH splash10-05mo-7900000000-bb5ac22b3307655403e5
Source of Spectrum KC-0-1288-21
Synonyms [(3aR,4R,6aS)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl]acetonitrile
Wiley ID 783888