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cis-Khellactone
SpectraBase Compound ID 4F0IwyKzXwq
InChI InChI=1S/C14H14O5/c1-14(2)13(17)11(16)10-8(19-14)5-3-7-4-6-9(15)18-12(7)10/h3-6,11,13,16-17H,1-2H3
InChIKey HKXQUNNSKMWIKJ-UHFFFAOYSA-N
Mol Weight 262.26 g/mol
Molecular Formula C14H14O5
Exact Mass 262.084124 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2zzioCtrBnU
Name (-)-cis-Khellactone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O5
InChI InChI=1S/C14H14O5/c1-14(2)13(17)11(16)10-8(19-14)5-3-7-4-6-9(15)18-12(7)10/h3-6,11,13,16-17H,1-2H3
InChIKey HKXQUNNSKMWIKJ-UHFFFAOYSA-N
Molecular Weight 262.261 g/mol
SMILES OC1c2c(OC(C1O)(C)C)ccc1C=CC(Oc21)=O
SPLASH splash10-052f-8910000000-160d08c2a1db0525227f
Source of Spectrum KC-0-3252-1
Synonyms Khellactone 8,9-Dihydroxy-7,7-dimethyl-6,7-dihydropyranobenzopyran-2-one 9,10-dihydroxy-8,8-dimethyl-9,10-dihydropyrano[2,3-f][1]benzopyran-2-one 8,8-Dimethyl-9,10-bis(oxidanyl)-9,10-dihydropyrano[2,3-f]chromen-2-one
Wiley ID 782637