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1-Phenyloct-2-yn-1-one

View entire compound with spectra: 1 MS (GC)

1-Phenyloct-2-yn-1-one
SpectraBase Compound ID JtV9VEtDX3j
InChI InChI=1S/C14H16O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5H2,1H3
InChIKey QIVSUAVNSMRZKM-UHFFFAOYSA-N
Mol Weight 200.28 g/mol
Molecular Formula C14H16O
Exact Mass 200.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2q5LbZKjnct
Name 1-Phenyloct-2-yn-1-one
Alternate Name(s) 1-Phenyl-2-octyn-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O
InChI InChI=1S/C14H16O/c1-2-3-4-5-9-12-14(15)13-10-7-6-8-11-13/h6-8,10-11H,2-5H2,1H3
InChIKey QIVSUAVNSMRZKM-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol102993y
Molecular Weight 200.281 g/mol
SMILES C(#CCCCCC)C(=O)c1ccccc1
SPLASH splash10-0a4i-0900000000-71b9dc37bc4eb644c4d0
Source of Spectrum A1-13-944/SMS7-3ab
Wiley ID 1752747