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.alpha.-D-Xylofuranoside, methyl 3,5-bis-O-[(4-chlorophenyl)methyl]-
SpectraBase Compound ID 77YGVSjz4pn
InChI InChI=1S/C20H22Cl2O5/c1-24-20-18(23)19(26-11-14-4-8-16(22)9-5-14)17(27-20)12-25-10-13-2-6-15(21)7-3-13/h2-9,17-20,23H,10-12H2,1H3/t17-,18-,19+,20+/m1/s1
InChIKey UFRYXHSGDCMKGK-ZRNYENFQSA-N
Mol Weight 413.3 g/mol
Molecular Formula C20H22Cl2O5
Exact Mass 412.084429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0pdWZtEbQt
Name .alpha.-D-Xylofuranoside, methyl 3,5-bis-O-[(4-chlorophenyl)methyl]-
Alternate Name(s) Methyl 3,5-bis-O-(4-chlorobenzyl)-.alpha.-D-xylofuranoside Methyl 3,5-di-O-(4-chlorobenzyl)-.alpha.-D-xylofuranoside
CAS Registry Number 114738-14-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22Cl2O5
InChI InChI=1S/C20H22Cl2O5/c1-24-20-18(23)19(26-11-14-4-8-16(22)9-5-14)17(27-20)12-25-10-13-2-6-15(21)7-3-13/h2-9,17-20,23H,10-12H2,1H3/t17-,18-,19+,20+/m1/s1
InChIKey UFRYXHSGDCMKGK-ZRNYENFQSA-N
Molecular Weight 413.297 g/mol
SMILES O[C@@]1([C@]([C@@](COCc2ccc(cc2)Cl)(O[C@@]1(OC)[H])[H])(OCc1ccc(cc1)Cl)[H])[H]
SPLASH splash10-004i-1900000000-2c0cf9d8fff377d90c52
Source of Spectrum J-53-3291-12
Wiley ID 1374337