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5-Acetyl-4-pentyl-6-methyl-2H-pyran-2-one

View entire compound with spectra: 1 MS (GC)

5-Acetyl-4-pentyl-6-methyl-2H-pyran-2-one
SpectraBase Compound ID HZNxc978CW8
InChI InChI=1S/C13H18O3/c1-4-5-6-7-11-8-12(15)16-10(3)13(11)9(2)14/h8H,4-7H2,1-3H3
InChIKey RFLVVVWEMZHLNF-UHFFFAOYSA-N
Mol Weight 222.28 g/mol
Molecular Formula C13H18O3
Exact Mass 222.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 71aiofYZKpL
Name 5-Acetyl-4-pentyl-6-methyl-2H-pyran-2-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3
InChI InChI=1S/C13H18O3/c1-4-5-6-7-11-8-12(15)16-10(3)13(11)9(2)14/h8H,4-7H2,1-3H3
InChIKey RFLVVVWEMZHLNF-UHFFFAOYSA-N
Molecular Weight 222.284 g/mol
SMILES C1(=C(OC(C=C1CCCCC)=O)C)C(=O)C
SPLASH splash10-000i-0900000000-4f0803597908f626f2ce
Source of Spectrum F-65-2114-3cc
Wiley ID 1681614