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(+,-)-(2S*,3S*,4S*,5R*)-4-[(2-methoxyethoxy)methoxy]-2,4,5-trimethyl-2-vinyl-3-tetrahydrofuranyl benzoate
SpectraBase Compound ID 9yBxshXeGAm
InChI InChI=1S/C20H28O6/c1-6-19(3)18(25-17(21)16-10-8-7-9-11-16)20(4,15(2)26-19)24-14-23-13-12-22-5/h6-11,15,18H,1,12-14H2,2-5H3/t15-,18+,19+,20+/m1/s1
InChIKey IPWXBVZHFKOALJ-TTYHFUOFSA-N
Mol Weight 364.44 g/mol
Molecular Formula C20H28O6
Exact Mass 364.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3v2iPnBtoun
Name (+,-)-(2S*,3S*,4S*,5R*)-4-[(2-methoxyethoxy)methoxy]-2,4,5-trimethyl-2-vinyl-3-tetrahydrofuranyl benzoate
Alternate Name(s) 2,5-anhydro-4-O-benzoyl-1,6,7-trideoxy-3-O-[(2-methoxyethoxy)methyl]-5-methyl-3-C-methyl-L-gluco-hept-6-enitol
CAS Registry Number 98168-77-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O6
InChI InChI=1S/C20H28O6/c1-6-19(3)18(25-17(21)16-10-8-7-9-11-16)20(4,15(2)26-19)24-14-23-13-12-22-5/h6-11,15,18H,1,12-14H2,2-5H3/t15-,18+,19+,20+/m1/s1
InChIKey IPWXBVZHFKOALJ-TTYHFUOFSA-N
Molecular Weight 364.438 g/mol
SMILES [C@@]1([C@]([C@@](C)(O[C@]1(C=C)C)[H])(OCOCCOC)C)(OC(=O)c1ccccc1)[H]
SPLASH splash10-000i-1900000000-457c123f1f73384e801c
Source of Spectrum J-52-5074-18
Wiley ID 1350792