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3-C-(Bromomethyl)-3-deoxy-1,2:5,6-di-O-isopropylidene-.alpha.-D-allofuranose
SpectraBase Compound ID B3lsz1deJai
InChI InChI=1S/C13H21BrO5/c1-12(2)15-6-8(17-12)9-7(5-14)10-11(16-9)19-13(3,4)18-10/h7-11H,5-6H2,1-4H3/t7-,8-,9+,10-,11-/m1/s1
InChIKey KMFXPMFPNWFZCC-KAMPLNKDSA-N
Mol Weight 337.21 g/mol
Molecular Formula C13H21BrO5
Exact Mass 336.057237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GiC4EHvE9jK
Name 3-C-(Bromomethyl)-3-deoxy-1,2:5,6-di-O-isopropylidene-.alpha.-D-allofuranose
Alternate Name(s) (4R)-4-[(3aR,5S,6R,6aR)-6-(bromomethyl)-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]-2,2-dimethyl-1,3-dioxolane
CAS Registry Number 79068-96-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H21BrO5
InChI InChI=1S/C13H21BrO5/c1-12(2)15-6-8(17-12)9-7(5-14)10-11(16-9)19-13(3,4)18-10/h7-11H,5-6H2,1-4H3/t7-,8-,9+,10-,11-/m1/s1
InChIKey KMFXPMFPNWFZCC-KAMPLNKDSA-N
Molecular Weight 337.210 g/mol
SMILES [C@@]12(O[C@]([C@@]3(OC(C)(C)OC3)[H])([C@]([C@]1(OC(O2)(C)C)[H])(CBr)[H])[H])[H]
SPLASH splash10-00di-0249000000-7987cd9399acf8c7d2d6
Source of Spectrum J-46-5208-2
Wiley ID 114858