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(3E,5S,6E,8S,9E,14R)-5,8-dihydroxy-14-methyl-1-oxacyclotetradeca-3,6,9-trien-2-one
SpectraBase Compound ID BffLcR7Mclj
InChI InChI=1S/C14H20O4/c1-11-5-3-2-4-6-12(15)7-8-13(16)9-10-14(17)18-11/h4,6-13,15-16H,2-3,5H2,1H3/b6-4+,8-7+,10-9+/t11-,12+,13+/m1/s1
InChIKey SAORJUUJHIHDBZ-ZBKWACTISA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVX57qD1Xp8
Name (3Z,6Z,9Z)-(5S,8S,14R)-5,8-Dihydroxy-14-methyl-oxacyclotetradeca-3,6,9-trien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-11-5-3-2-4-6-12(15)7-8-13(16)9-10-14(17)18-11/h4,6-13,15-16H,2-3,5H2,1H3/b6-4+,8-7+,10-9+/t11-,12+,13+/m1/s1
InChIKey SAORJUUJHIHDBZ-ZBKWACTISA-N
Molecular Weight 252.310 g/mol
SMILES O[C@@]1(\C=C\C(O[C@@](CCC\C=C\[C@@](\C=C\1)(O)[H])(C)[H])=O)[H]
SPLASH splash10-0a59-9300000000-2a7bfa8863ab0f91f14f
Source of Spectrum K1-2000-1455-1
Synonyms (5S,8S,14R)-5,8-dihydroxy-14-methyloxacyclotetradeca-3,6,9-trien-2-one 5,8-Dihydroxy-14-methyloxacyclotetradeca-3,6,9-trien-2-one Mutolide (3E,5S,6E,8S,9E,14R)-14-methyl-5,8-bis(oxidanyl)-1-oxacyclotetradeca-3,6,9-trien-2-one
Wiley ID 750197