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p-Benzoyl-o-(hex-1-ynyl)phenyl Acetate
SpectraBase Compound ID AQtfKBRvzhQ
InChI InChI=1S/C21H20O3/c1-3-4-5-7-12-18-15-19(13-14-20(18)24-16(2)22)21(23)17-10-8-6-9-11-17/h6,8-11,13-15H,3-5H2,1-2H3
InChIKey QWURBQPWYTZVTD-UHFFFAOYSA-N
Mol Weight 320.39 g/mol
Molecular Formula C21H20O3
Exact Mass 320.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2HWQBkr2cst
Name p-Benzoyl-o-(hex-1-ynyl)phenyl Acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O3
InChI InChI=1S/C21H20O3/c1-3-4-5-7-12-18-15-19(13-14-20(18)24-16(2)22)21(23)17-10-8-6-9-11-17/h6,8-11,13-15H,3-5H2,1-2H3
InChIKey QWURBQPWYTZVTD-UHFFFAOYSA-N
Molecular Weight 320.388 g/mol
SMILES c1(C(=O)c2ccccc2)cc(C#CCCCC)c(cc1)OC(=O)C
SPLASH splash10-056r-0590000000-d2e0471cc70b866fdffc
Source of Spectrum J-61-9286-12
Synonyms 4-Benzoyl-2-(1-hexynyl)phenyl acetate Acetic acid (4-benzoyl-2-hex-1-ynylphenyl) ester (4-benzoyl-2-hex-1-ynylphenyl) acetate (4-benzoyl-2-hex-1-ynyl-phenyl) acetate [2-hex-1-ynyl-4-(phenylcarbonyl)phenyl] ethanoate
Wiley ID 1320526