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(E)-1-(4-Acetyl-phenyl)oct-3-en-1-yne
SpectraBase Compound ID FqUhciI9o8V
InChI InChI=1S/C16H18O/c1-3-4-5-6-7-8-9-15-10-12-16(13-11-15)14(2)17/h6-7,10-13H,3-5H2,1-2H3/b7-6+
InChIKey VWQOTGGYCNPCGF-VOTSOKGWSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JmbTk4ZCi
Name (E)-1-(4-Acetyl-phenyl)oct-3-en-1-yne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18O
InChI InChI=1S/C16H18O/c1-3-4-5-6-7-8-9-15-10-12-16(13-11-15)14(2)17/h6-7,10-13H,3-5H2,1-2H3/b7-6+
InChIKey VWQOTGGYCNPCGF-VOTSOKGWSA-N
Molecular Weight 226.319 g/mol
SMILES C(#Cc1ccc(C(=O)C)cc1)\C=C\CCCC
SPLASH splash10-056r-0940000000-0b67292847e25e7f73c0
Source of Spectrum F4-0-2001-4
Synonyms (E)-1-(4-Acetoxyphenyl)oct-3-en-1-yne 1-{4-[(3E)-3-octen-1-ynyl]phenyl}ethanone
Wiley ID 1618407