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3-Pyridinecarbonitrile, 2-(1,3-benzodioxol-5-yloxy)-
SpectraBase Compound ID BtTCTvXSqWz
InChI InChI=1S/C13H8N2O3/c14-7-9-2-1-5-15-13(9)18-10-3-4-11-12(6-10)17-8-16-11/h1-6H,8H2
InChIKey APIBDRMLSXYGKZ-UHFFFAOYSA-N
Mol Weight 240.22 g/mol
Molecular Formula C13H8N2O3
Exact Mass 240.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBcpOF8HnAv
Name 3-Pyridinecarbonitrile, 2-(1,3-benzodioxol-5-yloxy)-
Alternate Name(s) 2-(1,3-benzodioxol-5-yloxy)-3-pyridinecarbonitrile 2-(1,3-benzodioxol-5-yloxy)pyridine-3-carbonitrile
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Formula C13H8N2O3
InChI InChI=1S/C13H8N2O3/c14-7-9-2-1-5-15-13(9)18-10-3-4-11-12(6-10)17-8-16-11/h1-6H,8H2
InChIKey APIBDRMLSXYGKZ-UHFFFAOYSA-N
Molecular Weight 240.218 g/mol
SMILES c1cc(c(Oc2ccc3c(c2)OCO3)nc1)C#N
SPLASH splash10-000f-5590000000-3b04b3fdc899a5898eba
Source of Spectrum IY-1-4404-1
Wiley ID 1652024