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3-Benzyl-1-bromo-5,6-O-isopropylidene-2-oxa-3-azabicyclo[2.2.2]oct-7-en-5,6-diol
SpectraBase Compound ID Hk7QG0EZUjH
InChI InChI=1S/C16H16BrNO4/c1-15(2)20-12-11-8-9-16(17,13(12)21-15)22-18(11)14(19)10-6-4-3-5-7-10/h3-9,11-13H,1-2H3
InChIKey XXRWSNJMGSBIJU-UHFFFAOYSA-N
Mol Weight 366.21 g/mol
Molecular Formula C16H16BrNO4
Exact Mass 365.026271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVm0FDrEcx3
Name 3-Benzyl-1-bromo-5,6-O-isopropylidene-2-oxa-3-azabicyclo[2.2.2]oct-7-en-5,6-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16BrNO4
InChI InChI=1S/C16H16BrNO4/c1-15(2)20-12-11-8-9-16(17,13(12)21-15)22-18(11)14(19)10-6-4-3-5-7-10/h3-9,11-13H,1-2H3
InChIKey XXRWSNJMGSBIJU-UHFFFAOYSA-N
Molecular Weight 366.211 g/mol
SMILES C12(ON(C(C=C2)C2C1OC(O2)(C)C)C(=O)c1ccccc1)Br
SPLASH splash10-056r-9800000000-badc30faec8cad734aaf
Source of Spectrum C-116-5113-21
Synonyms 3-Benzoyl-1-bromo-5,6-O-isopropylidene-2-oxa-3-azabicyclo[2.2.2]oct-7-en-5,6-diol
Wiley ID 1351294