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1,2,4-tri[O-acetyl]conduritol
SpectraBase Compound ID BFBok5FKFmG
InChI InChI=1S/C12H16O7/c1-6(13)17-9-4-5-10(18-7(2)14)12(11(9)16)19-8(3)15/h4-5,9-12,16H,1-3H3
InChIKey PVJVHGQHNXVKEP-UHFFFAOYSA-N
Mol Weight 272.25 g/mol
Molecular Formula C12H16O7
Exact Mass 272.089603 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2YTn0emwnZz
Name 1,2,4-tri[O-acetyl]conduritol
Alternate Name(s) 1,2,4-tris(Acetyloxy)-3-hydroxycyclohex-5-ene 2,5-bis(acetyloxy)-6-hydroxy-3-cyclohexen-1-yl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O7
InChI InChI=1S/C12H16O7/c1-6(13)17-9-4-5-10(18-7(2)14)12(11(9)16)19-8(3)15/h4-5,9-12,16H,1-3H3
InChIKey PVJVHGQHNXVKEP-UHFFFAOYSA-N
Molecular Weight 272.253 g/mol
SMILES OC1C(C(C=CC1OC(=O)C)OC(=O)C)OC(=O)C
SPLASH splash10-0006-9600000000-15cf4bdbcef1eec327ee
Source of Spectrum K1-2003-1969-46
Wiley ID 1521025