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4-(3,6-Dihydro-2H-pyran-4-yl)-3,5-dimethylisoxazole
SpectraBase Compound ID FhGN5p3IJkZ
InChI InChI=1S/C10H13NO2/c1-7-10(8(2)13-11-7)9-3-5-12-6-4-9/h3H,4-6H2,1-2H3
InChIKey GWKDRWFJYQFSGA-UHFFFAOYSA-N
Mol Weight 179.22 g/mol
Molecular Formula C10H13NO2
Exact Mass 179.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JUOnDHXdsAh
Name 4-(3,6-Dihydro-2H-pyran-4-yl)-3,5-dimethylisoxazole
Appearance Colorless oil
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Formula C10H13NO2
InChI InChI=1S/C10H13NO2/c1-7-10(8(2)13-11-7)9-3-5-12-6-4-9/h3H,4-6H2,1-2H3
InChIKey GWKDRWFJYQFSGA-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI pos
Literature Reference DOI 10.1002/anie.201810327
Molecular Weight 179.219 g/mol
Reported Formula C10H13NO2
SMILES C=1(CCOCC1)c1c(onc1C)C
SPLASH splash10-01tj-3900000000-315b49799b131d2b29ca
Source of Spectrum ACI-58-SM22-6n
Thin-Layer Chromatography Rf = 0.22 (hexane/EtOAc 80:20, UV, KMnO4, PAA)
Wiley ID 1840524