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Glucopyranoside, methyl 4,6-O-benzylidene-2-bromo-2-deoxy-, acetate, .alpha.-D-
SpectraBase Compound ID KdQFtSqHEQh
InChI InChI=1S/C16H19BrO6/c1-9(18)22-16(2)14(17)12(19)13-11(23-16)8-20-15(21-13)10-6-4-3-5-7-10/h3-7,11-15,19H,8H2,1-2H3/t11-,12+,13-,14-,15?,16?/m1/s1
InChIKey SRMFEPSMLHBWOF-ABSAPSEKSA-N
Mol Weight 387.23 g/mol
Molecular Formula C16H19BrO6
Exact Mass 386.036501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 79SrWq7Z7ra
Name Glucopyranoside, methyl 4,6-O-benzylidene-2-bromo-2-deoxy-, acetate, .alpha.-D-
CAS Registry Number 20853-47-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19BrO6
InChI InChI=1S/C16H19BrO6/c1-9(18)22-16(2)14(17)12(19)13-11(23-16)8-20-15(21-13)10-6-4-3-5-7-10/h3-7,11-15,19H,8H2,1-2H3/t11-,12+,13-,14-,15?,16?/m1/s1
InChIKey SRMFEPSMLHBWOF-ABSAPSEKSA-N
Molecular Weight 387.226 g/mol
SMILES O[C@@]1([C@](C(O[C@]2([C@]1(OC(OC2)c1ccccc1)[H])[H])(OC(=O)C)C)(Br)[H])[H]
SPLASH splash10-002s-9810000000-7807c488581d1d8ad00d
Source of Spectrum W5-32858-32678-32678
Synonyms 2-O-acetyl-5,7-O-benzylidene-3-bromo-1,3-dideoxy-D-gluco-hept-2-ulopyranose Glucopyranoside, methyl 4,6-O-benzylidene-2-bromo-2-deoxy-, acetate
Wiley ID 1362432