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Piperonylonitrile
SpectraBase Compound ID AQ0E01wDFeh
InChI InChI=1S/C8H5NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2
InChIKey PKRWWZCDLJSJIF-UHFFFAOYSA-N
Mol Weight 147.13 g/mol
Molecular Formula C8H5NO2
Exact Mass 147.032028 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID de3fg91RjD
Name Piperonylonitrile
CAS Registry Number 4421-09-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H5NO2
InChI InChI=1S/C8H5NO2/c9-4-6-1-2-7-8(3-6)11-5-10-7/h1-3H,5H2
InChIKey PKRWWZCDLJSJIF-UHFFFAOYSA-N
Molecular Weight 147.133 g/mol
SMILES C(#N)c1cc2c(cc1)OCO2
SPLASH splash10-0002-5900000000-76083ed95f16e7f2e14f
Source of Spectrum JZ-1992-4395-0
Synonyms Piperonylnitrile 1,3-Benzodioxole-5-carbonitrile 3,4-Methylene dioxy benzonitrile Benzo[d][1,3]dioxole-5-carbonitrile Benzo-1,3-dioxole-5-carbonitrile Benzonitrile, 3,4-methylenedioxy- AI3-31574 BRN 0006224 EINECS 224-590-6 NSC 27009
Wiley ID 1144811