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D-altro-Non-8-enitol, 2,6-anhydro-3,7,8,9-tetradeoxy-5-C-methyl-4-O-(phenylmethyl)-, 1-(4-methylbenzenesulfonate)
SpectraBase Compound ID B41hTfiqnvM
InChI InChI=1S/C24H30O6S/c1-4-8-22-24(27-3)23(28-16-19-9-6-5-7-10-19)15-20(30-22)17-29-31(25,26)21-13-11-18(2)12-14-21/h4-7,9-14,20,22-24H,1,8,15-17H2,2-3H3
InChIKey BRELXACTGOIZEL-UHFFFAOYSA-N
Mol Weight 446.56 g/mol
Molecular Formula C24H30O6S
Exact Mass 446.17631 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EuyhAI15Tvm
Name D-altro-Non-8-enitol, 2,6-anhydro-3,7,8,9-tetradeoxy-5-C-methyl-4-O-(phenylmethyl)-, 1-(4-methylbenzenesulfonate)
Alternate Name(s) 2,6-Anhydro-4-O-benzyl-3,7,8,9-tetradeoxy-5-methyl-D-altro-non-8-enitol 1-p-toluenesulfonate 4,8-anhydro-6-O-benzyl-1,2,3,7-tetradeoxy-5-O-methyl-9-O-[(4-methylphenyl)sulfonyl]non-1-enitol
CAS Registry Number 122821-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H30O6S
InChI InChI=1S/C24H30O6S/c1-4-8-22-24(27-3)23(28-16-19-9-6-5-7-10-19)15-20(30-22)17-29-31(25,26)21-13-11-18(2)12-14-21/h4-7,9-14,20,22-24H,1,8,15-17H2,2-3H3
InChIKey BRELXACTGOIZEL-UHFFFAOYSA-N
Molecular Weight 446.558 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)C1OC(CC=C)C(C(C1)OCc1ccccc1)OC
SPLASH splash10-001i-0961300000-bb5204ff6d71473c2587
Source of Spectrum C-111-6687-17
Wiley ID 1386584