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(2S,3R)-3-Benzoyloxy-8-acetoxy-1,2-octandiol
SpectraBase Compound ID 4EhBRG6YMm9
InChI InChI=1S/C17H24O6/c1-13(19)22-11-7-3-6-10-16(15(20)12-18)23-17(21)14-8-4-2-5-9-14/h2,4-5,8-9,15-16,18,20H,3,6-7,10-12H2,1H3/t15-,16+/m0/s1
InChIKey AAAROCLORGTNFM-JKSUJKDBSA-N
Mol Weight 324.37 g/mol
Molecular Formula C17H24O6
Exact Mass 324.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dsn93m2om2
Name (2S,3R)-3-Benzoyloxy-8-acetoxy-1,2-octandiol
Alternate Name(s) (1R)-6-(acetyloxy)-1-[(1S)-1,2-dihydroxyethyl]hexyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O6
InChI InChI=1S/C17H24O6/c1-13(19)22-11-7-3-6-10-16(15(20)12-18)23-17(21)14-8-4-2-5-9-14/h2,4-5,8-9,15-16,18,20H,3,6-7,10-12H2,1H3/t15-,16+/m0/s1
InChIKey AAAROCLORGTNFM-JKSUJKDBSA-N
Molecular Weight 324.373 g/mol
SMILES O[C@@](CO)([C@](OC(=O)c1ccccc1)(CCCCCOC(=O)C)[H])[H]
SPLASH splash10-0a4i-4900000000-d36f00c9a81a0033f98d
Source of Spectrum QC-3-578-6
Wiley ID 883087