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PATHYLACTONE-A

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PATHYLACTONE-A
SpectraBase Compound ID CYaupB0Vm0T
InChI InChI=1S/C14H22O4/c1-9-4-5-11(16)14(7-6-12(17)18-14)13(9,3)8-10(2)15/h9,11,16H,4-8H2,1-3H3/t9-,11+,13+,14-/m0/s1
InChIKey IAQWIMUGUMQBNL-FRJFDASCSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkvzBo6CGNf
Name (5R,6R,7S,10R)-10-hydroxy-6,7-dimethyl-6-(2-oxopropyl)-1-oxaspiro[4.5]decan-2-one
Alternate Name(s) (5R,6R,7S,10R)-6,7-dimethyl-10-oxidanyl-6-(2-oxidanylidenepropyl)-1-oxaspiro[4.5]decan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-9-4-5-11(16)14(7-6-12(17)18-14)13(9,3)8-10(2)15/h9,11,16H,4-8H2,1-3H3/t9-,11+,13+,14-/m0/s1
InChIKey IAQWIMUGUMQBNL-FRJFDASCSA-N
Molecular Weight 254.326 g/mol
SMILES O[C@]1([C@@]2([C@](CC(=O)C)([C@@](C)(CC1)[H])C)OC(=O)CC2)[H]
SPLASH splash10-014i-1910000000-8d231cbc363e48c0a4aa
Source of Spectrum X2-56-291-1
Wiley ID 1604763