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(E)-6-Phenylhex-3-en-5-yn-2-one
SpectraBase Compound ID 1ACvRb3ElZk
InChI InChI=1S/C12H10O/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-5,7-9H,1H3/b7-5+
InChIKey FDGMOOZVRWSPIX-FNORWQNLSA-N
Mol Weight 170.21 g/mol
Molecular Formula C12H10O
Exact Mass 170.073165 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LNSl4QCo6Xf
Name (E)-6-Phenylhex-3-en-5-yn-2-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10O
InChI InChI=1S/C12H10O/c1-11(13)7-5-6-10-12-8-3-2-4-9-12/h2-5,7-9H,1H3/b7-5+
InChIKey FDGMOOZVRWSPIX-FNORWQNLSA-N
Literature Reference DOI 10.1021/ol502551u
Molecular Weight 170.211 g/mol
SMILES c1ccc(C#C\C=C\C(C)=O)cc1
SPLASH splash10-05fr-0900000000-6f53d35c5739960a41b5
Source of Spectrum A1-16-5188/SM5-2a
Synonyms (3E)-6-phenyl-3-hexen-5-yn-2-one (E)-6-phenyl-2-hex-3-en-5-ynone
Wiley ID 1751353