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3-Acetoxy-4-methyl-1-phenyl-1-pentyne
SpectraBase Compound ID 7Y57swRdDHU
InChI InChI=1S/C14H16O2/c1-11(2)14(16-12(3)15)10-9-13-7-5-4-6-8-13/h4-8,11,14H,1-3H3
InChIKey LFXBQPIXAFMXKT-UHFFFAOYSA-N
Mol Weight 216.28 g/mol
Molecular Formula C14H16O2
Exact Mass 216.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FE6Gcbx2W8t
Name 3-Acetoxy-4-methyl-1-phenyl-1-pentyne
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O2
InChI InChI=1S/C14H16O2/c1-11(2)14(16-12(3)15)10-9-13-7-5-4-6-8-13/h4-8,11,14H,1-3H3
InChIKey LFXBQPIXAFMXKT-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol500046e
Molecular Weight 216.280 g/mol
SMILES c1(ccccc1)C#CC(OC(C)=O)C(C)C
SPLASH splash10-008c-1900000000-3317a84e7eeb9b41b653
Source of Spectrum A1-16-1176/SMS8-2j
Synonyms 4-Methyl-1-phenylpent-1-yn-3-yl acetate
Wiley ID 1749160