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5-Acetyl-4-pentyl-6-phenyl-2H-pyran-2-one
SpectraBase Compound ID KA41QoZqjsC
InChI InChI=1S/C18H20O3/c1-3-4-6-11-15-12-16(20)21-18(17(15)13(2)19)14-9-7-5-8-10-14/h5,7-10,12H,3-4,6,11H2,1-2H3
InChIKey PYNQTQHOBXWUQF-UHFFFAOYSA-N
Mol Weight 284.36 g/mol
Molecular Formula C18H20O3
Exact Mass 284.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hQ3qJaCCtM
Name 5-Acetyl-4-pentyl-6-phenyl-2H-pyran-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O3
InChI InChI=1S/C18H20O3/c1-3-4-6-11-15-12-16(20)21-18(17(15)13(2)19)14-9-7-5-8-10-14/h5,7-10,12H,3-4,6,11H2,1-2H3
InChIKey PYNQTQHOBXWUQF-UHFFFAOYSA-N
Molecular Weight 284.355 g/mol
SMILES C1(=C(C(CCCCC)=CC(O1)=O)C(=O)C)c1ccccc1
SPLASH splash10-0ue9-0090000000-095765d835055da1fa48
Source of Spectrum F-65-2114-3cb
Wiley ID 1681615