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1,4,5-Tri-O-acetyl-2,6-anhydro-3-O-heptylhexitol
SpectraBase Compound ID 6GFxeYx6ESO
InChI InChI=1S/C19H32O8/c1-5-6-7-8-9-10-23-18-16(11-24-13(2)20)25-12-17(26-14(3)21)19(18)27-15(4)22/h16-19H,5-12H2,1-4H3/t16-,17+,18-,19-/m1/s1
InChIKey XJTXTXJRFUWSSS-FCGDIQPGSA-N
Mol Weight 388.5 g/mol
Molecular Formula C19H32O8
Exact Mass 388.209718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8xU9xSNpbtO
Name 1,4,5-Tri-O-acetyl-2,6-anhydro-3-O-heptylhexitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32O8
InChI InChI=1S/C19H32O8/c1-5-6-7-8-9-10-23-18-16(11-24-13(2)20)25-12-17(26-14(3)21)19(18)27-15(4)22/h16-19H,5-12H2,1-4H3/t16-,17+,18-,19-/m1/s1
InChIKey XJTXTXJRFUWSSS-FCGDIQPGSA-N
Molecular Weight 388.457 g/mol
SMILES C(=O)(O[C@]1(CO[C@@]([C@]([C@@]1(OC(=O)C)[H])(OCCCCCCC)[H])(COC(=O)C)[H])[H])C
SPLASH splash10-052f-9720000000-716b95805882c9c1731f
Synonyms (4,5-diacetoxy-3-heptoxy-tetrahydropyran-2-yl)methyl acetate (4,5-diacetyloxy-3-heptoxy-oxan-2-yl)methyl ethanoate (4,5-diacetyloxy-3-heptoxyoxan-2-yl)methyl acetate Acetic acid (4,5-diacetoxy-3-heptoxy-tetrahydropyran-2-yl)methyl ester Acetic acid (4,5-diacetyloxy-3-heptoxy-2-oxanyl)methyl ester D-Glucitol, 1,5-anhydro-2,3,6-tri-O-acetyl-4-O-heptyl-
Wiley ID 1497586