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1,4-Bis(acetyloxy)bicyclo[2.2.2]octane-2,3-dicarboxylic acid
SpectraBase Compound ID CcLwQTC7mT1
InChI InChI=1S/C14H18O8/c1-7(15)21-13-3-5-14(6-4-13,22-8(2)16)10(12(19)20)9(13)11(17)18/h9-10H,3-6H2,1-2H3,(H,17,18)(H,19,20)
InChIKey UBJDLLDSAJSTEF-UHFFFAOYSA-N
Mol Weight 314.29 g/mol
Molecular Formula C14H18O8
Exact Mass 314.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DqcPJv3wgG
Name 1,4-Bis(acetyloxy)bicyclo[2.2.2]octane-2,3-dicarboxylic acid
Alternate Name(s) 1,4-Diacetoxybicyclo[2.2.2]octane-2,3-dicarboxylic acid
CAS Registry Number 17206-90-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O8
InChI InChI=1S/C14H18O8/c1-7(15)21-13-3-5-14(6-4-13,22-8(2)16)10(12(19)20)9(13)11(17)18/h9-10H,3-6H2,1-2H3,(H,17,18)(H,19,20)
InChIKey UBJDLLDSAJSTEF-UHFFFAOYSA-N
Molecular Weight 314.290 g/mol
SMILES OC(C1C2(CCC(C1C(O)=O)(CC2)OC(=O)C)OC(C)=O)=O
SPLASH splash10-0006-9200000000-bbc3564decfee81424cb
Source of Spectrum NP-10-8716-0
Wiley ID 1109199