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(1R,3R,5S)-5-(4-Methoxybenzoyl)-1,3-bis(methoxycarbonyl)cyclohexane
SpectraBase Compound ID Boh9KBBcxsv
InChI InChI=1S/C11H16O6/c1-16-10(14)7-3-6(9(12)13)4-8(5-7)11(15)17-2/h6-8H,3-5H2,1-2H3,(H,12,13)/t6-,7+,8-
InChIKey PZFDNDQDHXLHPE-RNLVFQAGSA-N
Mol Weight 244.24 g/mol
Molecular Formula C11H16O6
Exact Mass 244.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2AEBNrVSOdI
Name (1R,3R,5S)-5-(4-Methoxybenzoyl)-1,3-bis(methoxycarbonyl)cyclohexane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O6
InChI InChI=1S/C11H16O6/c1-16-10(14)7-3-6(9(12)13)4-8(5-7)11(15)17-2/h6-8H,3-5H2,1-2H3,(H,12,13)/t6-,7+,8-
InChIKey PZFDNDQDHXLHPE-RNLVFQAGSA-N
Molecular Weight 244.243 g/mol
SMILES OC([C@]1(C[C@](C(=O)OC)(C[C@@](C1)(C(=O)OC)[H])[H])[H])=O
SPLASH splash10-004i-9130000000-679d4cafb89fb3000dc3
Source of Spectrum F-53-12500-9
Synonyms (3R,5S)-3,5-bis(methoxycarbonyl)cyclohexanecarboxylic acid (3S*,5R*)-cis-3,5-Bis(methoxycarbonyl)cyclohexanecarboxylic acid
Wiley ID 803586