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2-(3-Aminophenyl)-4-oxo-1-oxaspiro[4.5]dec-2-ene-3-carbonitrile
SpectraBase Compound ID DSMwNIjj3J5
InChI InChI=1S/C16H16N2O2/c17-10-13-14(11-5-4-6-12(18)9-11)20-16(15(13)19)7-2-1-3-8-16/h4-6,9H,1-3,7-8,18H2
InChIKey IUIKXOYHEVSSOW-UHFFFAOYSA-N
Mol Weight 268.32 g/mol
Molecular Formula C16H16N2O2
Exact Mass 268.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPhHSOnTj0l
Name 2-(3-Aminophenyl)-4-oxo-1-oxaspiro[4.5]dec-2-ene-3-carbonitrile
Appearance Yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N2O2
InChI InChI=1S/C16H16N2O2/c17-10-13-14(11-5-4-6-12(18)9-11)20-16(15(13)19)7-2-1-3-8-16/h4-6,9H,1-3,7-8,18H2
InChIKey IUIKXOYHEVSSOW-UHFFFAOYSA-N
Instrument Name Agilent 5975C
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0013.827
Molecular Weight 268.316 g/mol
SMILES Nc1cccc(C2=C(C(C3(O2)CCCCC3)=O)C#N)c1
SPLASH splash10-02tc-1390000000-00ac55c8531853b69c57
Source of Spectrum ARK-2012-323-2c
Wiley ID 1864807