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Methyl 2,4-di-o-(4-methoxybenzylidene)-3,6-dideoxy-6-iodo-3-methyl-.alpha.-d-idopyranoside
SpectraBase Compound ID HnoiyqqBEBD
InChI InChI=1S/C16H21IO5/c1-9-13-12(8-17)20-16(19-3)14(9)22-15(21-13)10-4-6-11(18-2)7-5-10/h4-7,9,12-16H,8H2,1-3H3/t9-,12-,13-,14+,15?,16-/m1/s1
InChIKey VVPRJNZOAFWVAR-WNHJETGOSA-N
Mol Weight 420.24 g/mol
Molecular Formula C16H21IO5
Exact Mass 420.043369 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8hYxG2KK62G
Name Methyl 2,4-di-o-(4-methoxybenzylidene)-3,6-dideoxy-6-iodo-3-methyl-.alpha.-d-idopyranoside
Alternate Name(s) Methyl 3,6-dideoxy-6-iodo-2,4-O-(4-methoxybenzylidene)-3-methyl-.beta.-D-idopyranoside
CAS Registry Number 127258-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21IO5
InChI InChI=1S/C16H21IO5/c1-9-13-12(8-17)20-16(19-3)14(9)22-15(21-13)10-4-6-11(18-2)7-5-10/h4-7,9,12-16H,8H2,1-3H3/t9-,12-,13-,14+,15?,16-/m1/s1
InChIKey VVPRJNZOAFWVAR-WNHJETGOSA-N
Molecular Weight 420.243 g/mol
SMILES [C@]12(OC(O[C@]([C@]2(C)[H])([C@@](CI)(O[C@]1(OC)[H])[H])[H])c1ccc(cc1)OC)[H]
SPLASH splash10-000i-0910100000-be7d00445636cfbbb582
Source of Spectrum J-55-2774-16
Wiley ID 1377751