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(5R,8R)-1-(Benzoyloxy)-5,8-dodecanediol

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(5R,8R)-1-(Benzoyloxy)-5,8-dodecanediol
SpectraBase Compound ID 5hLt2ixJMWm
InChI InChI=1S/C19H30O4/c1-2-3-11-17(20)13-14-18(21)12-7-8-15-23-19(22)16-9-5-4-6-10-16/h4-6,9-10,17-18,20-21H,2-3,7-8,11-15H2,1H3/t17-,18-/m1/s1
InChIKey FHCJWBMOZMEEBF-QZTJIDSGSA-N
Mol Weight 322.45 g/mol
Molecular Formula C19H30O4
Exact Mass 322.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmiBuzvAmHQ
Name (5R,8R)-1-(Benzoyloxy)-5,8-dodecanediol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O4
InChI InChI=1S/C19H30O4/c1-2-3-11-17(20)13-14-18(21)12-7-8-15-23-19(22)16-9-5-4-6-10-16/h4-6,9-10,17-18,20-21H,2-3,7-8,11-15H2,1H3/t17-,18-/m1/s1
InChIKey FHCJWBMOZMEEBF-QZTJIDSGSA-N
Molecular Weight 322.445 g/mol
SMILES O[C@@](CC[C@](O)(CCCCOC(=O)c1ccccc1)[H])(CCCC)[H]
SPLASH splash10-0a4i-0900000000-c93c7df0a3683b666541
Source of Spectrum J-57-5188-46
Synonyms benzoic acid[(5R,8R)-5,8-dihydroxydodecyl]ester [(5R,8R)-5,8-bis(oxidanyl)dodecyl]benzoate [(5R,8R)-5,8-dihydroxydodecyl]benzoate [(5R,8R)-5,8-dihydroxydodecyl] benzoate [(5R,8R)-5,8-bis(oxidanyl)dodecyl] benzoate
Wiley ID 1321855