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1,4-Benzodioxan-2-carbonitrile
SpectraBase Compound ID CCoywa577rl
InChI InChI=1S/C9H7NO2/c10-5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7H,6H2
InChIKey DNLJHDDOVWQQEW-UHFFFAOYSA-N
Mol Weight 161.16 g/mol
Molecular Formula C9H7NO2
Exact Mass 161.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HXVyRaOdTJD
Name 1,4-Benzodioxan-2-carbonitrile
Alternate Name(s) 2,3-Dihydro-1,4-benzodioxin-3-carbonitrile 2,3-Dihydro-1,4-benzodioxine-3-carbonitrile 2-Cyano-1,4-benzodioxan
CAS Registry Number 1008-92-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7NO2
InChI InChI=1S/C9H7NO2/c10-5-7-6-11-8-3-1-2-4-9(8)12-7/h1-4,7H,6H2
InChIKey DNLJHDDOVWQQEW-UHFFFAOYSA-N
Molecular Weight 161.160 g/mol
SMILES c12OC(COc2cccc1)C#N
SPLASH splash10-0ue9-9100000000-66f7c2bf9d6dd518d36c
Source of Spectrum Y-15-778-6
Wiley ID 1157668