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5-(4-Acetylphenyl)-6-hexyl-2H-pyran-2-one
SpectraBase Compound ID 5NxB0YtanBD
InChI InChI=1S/C18H22O3/c1-3-4-5-6-7-17-16(12-13-18(19)21-17)14-8-10-15(20-2)11-9-14/h8-13H,3-7H2,1-2H3
InChIKey MRMNUGXEJMAXST-UHFFFAOYSA-N
Mol Weight 286.37 g/mol
Molecular Formula C18H22O3
Exact Mass 286.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FBTXMu6gwGX
Name 5-(4-Acetylphenyl)-6-hexyl-2H-pyran-2-one
Alternate Name(s) 5-(4-Methoxy-phenyl)-6-hexyl-2H-pyran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3
InChI InChI=1S/C18H22O3/c1-3-4-5-6-7-17-16(12-13-18(19)21-17)14-8-10-15(20-2)11-9-14/h8-13H,3-7H2,1-2H3
InChIKey MRMNUGXEJMAXST-UHFFFAOYSA-N
Molecular Weight 286.371 g/mol
SMILES C1(=C(OC(C=C1)=O)CCCCCC)c1ccc(cc1)OC
SPLASH splash10-000b-0920000000-c908bb3354fba397ba29
Source of Spectrum AT-42-2862-7
Wiley ID 855045