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3-(3',4'-Methylenedioxyphenyl)-5-cyano-4,5-dihydroisoxazole
SpectraBase Compound ID G16Pd48vR29
InChI InChI=1S/C11H8N2O3/c12-5-8-4-9(13-16-8)7-1-2-10-11(3-7)15-6-14-10/h1-3,8H,4,6H2
InChIKey GQPRHPWCDUSHLS-UHFFFAOYSA-N
Mol Weight 216.2 g/mol
Molecular Formula C11H8N2O3
Exact Mass 216.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NxrxY54Gub
Name 3-(3',4'-Methylenedioxyphenyl)-5-cyano-4,5-dihydroisoxazole
Alternate Name(s) 3-(1,3-benzodioxol-5-yl)-4,5-dihydro-5-isoxazolecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O3
InChI InChI=1S/C11H8N2O3/c12-5-8-4-9(13-16-8)7-1-2-10-11(3-7)15-6-14-10/h1-3,8H,4,6H2
InChIKey GQPRHPWCDUSHLS-UHFFFAOYSA-N
Molecular Weight 216.196 g/mol
SMILES C1(=NOC(C1)C#N)c1cc2OCOc2cc1
SPLASH splash10-00kf-0940000000-433b417a9e8da250b16b
Source of Spectrum Y1-36-243-6
Wiley ID 1526962