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6-Aminobenzo[1,3]dioxole-5-carbonitrile

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6-Aminobenzo[1,3]dioxole-5-carbonitrile
SpectraBase Compound ID BSQPUwzjh40
InChI InChI=1S/C8H6N2O2/c9-3-5-1-7-8(2-6(5)10)12-4-11-7/h1-2H,4,10H2
InChIKey WHSLUSAPNOCFII-UHFFFAOYSA-N
Mol Weight 162.15 g/mol
Molecular Formula C8H6N2O2
Exact Mass 162.042927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LcE9UHmba3M
Name 6-Aminobenzo[1,3]dioxole-5-carbonitrile
Alternate Name(s) 6-Amino-1,3-benzodioxole-5-carbonitrile 6-Amino-piperonylonitrile 6-Azanyl-1,3-benzodioxole-5-carbonitrile
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Formula C8H6N2O2
InChI InChI=1S/C8H6N2O2/c9-3-5-1-7-8(2-6(5)10)12-4-11-7/h1-2H,4,10H2
InChIKey WHSLUSAPNOCFII-UHFFFAOYSA-N
Molecular Weight 162.148 g/mol
SMILES Nc1cc2c(cc1C#N)OCO2
SPLASH splash10-0ik9-9800000000-57766d87b23c000cee9e
Wiley ID 1439511