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3-O-Benzyl-5-deoxy-5-iodo-1,2-O-isopropylidene-4a-carba-.alpha.-DL-xylofuranose
SpectraBase Compound ID GkwddvQI8Bm
InChI InChI=1S/C16H21IO3/c1-16(2)19-13-8-12(9-17)14(15(13)20-16)18-10-11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14+,15+/m1/s1
InChIKey GDEHUXFDFUZSPH-QPSCCSFWSA-N
Mol Weight 388.25 g/mol
Molecular Formula C16H21IO3
Exact Mass 388.05354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2PGLTwxEBJu
Name 3-O-Benzyl-5-deoxy-5-iodo-1,2-O-isopropylidene-4a-carba-.alpha.-DL-xylofuranose
Alternate Name(s) 4-(benzyloxy)-5-(iodomethyl)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxole benzyl 5-(iodomethyl)-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-yl ether
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21IO3
InChI InChI=1S/C16H21IO3/c1-16(2)19-13-8-12(9-17)14(15(13)20-16)18-10-11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14+,15+/m1/s1
InChIKey GDEHUXFDFUZSPH-QPSCCSFWSA-N
Molecular Weight 388.245 g/mol
SMILES [C@@]12([C@@](OC(O2)(C)C)(C[C@@]([C@@]1(OCc1ccccc1)[H])(CI)[H])[H])[H]
SPLASH splash10-0006-9001000000-6bc98cecbba0ff7fd9af
Source of Spectrum F-54-11049-6
Wiley ID 808799