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1-(2-allyloxy-5-bromo-phenyl)-4-keto-cyclohex-2-ene-1-carbonitrile
SpectraBase Compound ID 6N0u4Vp8T6r
InChI InChI=1S/C16H14BrNO2/c1-2-9-20-15-4-3-12(17)10-14(15)16(11-18)7-5-13(19)6-8-16/h2-5,7,10H,1,6,8-9H2
InChIKey IFLGEPBUDKRHFL-UHFFFAOYSA-N
Mol Weight 332.2 g/mol
Molecular Formula C16H14BrNO2
Exact Mass 331.020792 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOwigd7dgwO
Name 1-(2-allyloxy-5-bromo-phenyl)-4-keto-cyclohex-2-ene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14BrNO2
InChI InChI=1S/C16H14BrNO2/c1-2-9-20-15-4-3-12(17)10-14(15)16(11-18)7-5-13(19)6-8-16/h2-5,7,10H,1,6,8-9H2
InChIKey IFLGEPBUDKRHFL-UHFFFAOYSA-N
Molecular Weight 332.197 g/mol
SMILES C1(C=CC(CC1)(C#N)c1c(ccc(c1)Br)OCC=C)=O
SPLASH splash10-02t9-0009000000-2962e47a5adbe780722b
Source of Spectrum K-2002-1120-17
Synonyms 1-(2-allyloxy-5-bromo-phenyl)-4-oxo-cyclohex-2-ene-1-carbonitrile 1-(5-bromanyl-2-prop-2-enoxy-phenyl)-4-oxidanylidene-cyclohex-2-ene-1-carbonitrile 1-(5-bromo-2-prop-2-enoxyphenyl)-4-oxo-1-cyclohex-2-enecarbonitrile 1-(5-bromo-2-prop-2-enoxyphenyl)-4-oxocyclohex-2-ene-1-carbonitrile
Wiley ID 1581184