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Furan, tetrahydro-2-(1-octenyl)-3,4-bis(phenylmethoxy)-5-[(phenylmethoxy)methyl]-, [2R-[2.alpha.(Z),3.alpha.,4.alpha.,5.beta.]]-
SpectraBase Compound ID 6zSCoc6VG6t
InChI InChI=1S/C34H42O4/c1-2-3-4-5-6-16-23-31-33(36-25-29-19-12-8-13-20-29)34(37-26-30-21-14-9-15-22-30)32(38-31)27-35-24-28-17-10-7-11-18-28/h7-23,31-34H,2-6,24-27H2,1H3/b23-16-/t31-,32-,33+,34-/m1/s1
InChIKey YRIXUVACTAAGDZ-BTSBXABISA-N
Mol Weight 514.7 g/mol
Molecular Formula C34H42O4
Exact Mass 514.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhEzmdtXgzZ
Name Furan, tetrahydro-2-(1-octenyl)-3,4-bis(phenylmethoxy)-5-[(phenylmethoxy)methyl]-, [2R-[2.alpha.(Z),3.alpha.,4.alpha.,5.beta.]]-
Alternate Name(s) (1R)-1,4-anhydro-2,3,5-tri-O-benzyl-1-[(1Z)-1-octenyl]-D-ribitol 1-(2,3,5-tri-O-benzyl-.alpha.-D-ribosyl)-1(Z)-octene
CAS Registry Number 113794-38-0
Comments Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 1401237 moved to the Legacy library
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H42O4
InChI InChI=1S/C34H42O4/c1-2-3-4-5-6-16-23-31-33(36-25-29-19-12-8-13-20-29)34(37-26-30-21-14-9-15-22-30)32(38-31)27-35-24-28-17-10-7-11-18-28/h7-23,31-34H,2-6,24-27H2,1H3/b23-16-/t31-,32-,33+,34-/m1/s1
InChIKey YRIXUVACTAAGDZ-BTSBXABISA-N
Molecular Weight 514.706 g/mol
SMILES [C@]1([C@]([C@@](\C=C/CCCCCC)(O[C@@]1(COCc1ccccc1)[H])[H])(OCc1ccccc1)[H])(OCc1ccccc1)[H]
SPLASH splash10-000i-9000000000-e1f8e050da1c3e55f9e7
Source of Spectrum C-110-2504-0
Wiley ID 1821147