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Ethyl 5-bromo-2-cyano-3-phenylhex-5-enoate

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Ethyl 5-bromo-2-cyano-3-phenylhex-5-enoate
SpectraBase Compound ID 5SqCKuwTPLF
InChI InChI=1S/C15H16BrNO2/c1-3-19-15(18)14(10-17)13(9-11(2)16)12-7-5-4-6-8-12/h4-8,13-14H,2-3,9H2,1H3
InChIKey QTTAGXWPHAACBY-UHFFFAOYSA-N
Mol Weight 322.2 g/mol
Molecular Formula C15H16BrNO2
Exact Mass 321.036442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgixuToH8gK
Name Ethyl 5-bromo-2-cyano-3-phenylhex-5-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16BrNO2
InChI InChI=1S/C15H16BrNO2/c1-3-19-15(18)14(10-17)13(9-11(2)16)12-7-5-4-6-8-12/h4-8,13-14H,2-3,9H2,1H3
InChIKey QTTAGXWPHAACBY-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol802012q
Molecular Weight 322.202 g/mol
SMILES C(=C)(Br)CC(c1ccccc1)C(C(OCC)=O)C#N
SPLASH splash10-004i-1910000000-05277a8790adad641e78
Source of Spectrum A1-10-5285/SMS8-9b
Wiley ID 1756352