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trans-4-hydroxy-6-methyl-3-(5-methyl-2-cyclohexen-1-yl)-2-pyrone
SpectraBase Compound ID FozkntNHK54
InChI InChI=1S/C13H16O3/c1-8-4-3-5-10(6-8)12-11(14)7-9(2)16-13(12)15/h3,5,7-8,10,14H,4,6H2,1-2H3/t8-,10-/m0/s1
InChIKey ZOKGJKGKPCPEMN-WPRPVWTQSA-N
Mol Weight 220.27 g/mol
Molecular Formula C13H16O3
Exact Mass 220.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LHH4XAAUFr7
Name trans-4-hydroxy-6-methyl-3-(5-methyl-2-cyclohexen-1-yl)-2-pyrone
CAS Registry Number 116503-96-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O3
InChI InChI=1S/C13H16O3/c1-8-4-3-5-10(6-8)12-11(14)7-9(2)16-13(12)15/h3,5,7-8,10,14H,4,6H2,1-2H3/t8-,10-/m0/s1
InChIKey ZOKGJKGKPCPEMN-WPRPVWTQSA-N
Molecular Weight 220.268 g/mol
SMILES OC1=C(C(OC(=C1)C)=O)[C@]1(C=CC[C@@](C1)(C)[H])[H]
SPLASH splash10-00dl-8590000000-576142e50f58ed6e7d4f
Source of Spectrum J-53-5333-0
Synonyms 4-Hydroxy-6-methyl-3-[(1R,5S)-5-methyl-2-cyclohexen-1-yl]-2H-pyran-2-one
Wiley ID 1219918