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(1E,3E)-4-(Tri-O-acetyl-D-erythro-tritol-1-yl)-1-(4-bromophenyl)-1,2-diaza-1,3-butandiene
SpectraBase Compound ID DKmhfCC9L6l
InChI InChI=1S/C17H19BrN2O6/c1-11(21)24-10-17(26-13(3)23)16(25-12(2)22)8-9-19-20-15-6-4-14(18)5-7-15/h4-9,16-17H,10H2,1-3H3/b9-8+,20-19+/t16-,17+/m0/s1
InChIKey LSNBYUMSSSAQMA-FJDXEMOKSA-N
Mol Weight 427.25 g/mol
Molecular Formula C17H19BrN2O6
Exact Mass 426.042649 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1zztULMWp4D
Name (1E,3E)-4-(Tri-O-acetyl-D-erythro-tritol-1-yl)-1-(4-bromophenyl)-1,2-diaza-1,3-butandiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H19BrN2O6
InChI InChI=1S/C17H19BrN2O6/c1-11(21)24-10-17(26-13(3)23)16(25-12(2)22)8-9-19-20-15-6-4-14(18)5-7-15/h4-9,16-17H,10H2,1-3H3/b9-8+,20-19+/t16-,17+/m0/s1
InChIKey LSNBYUMSSSAQMA-FJDXEMOKSA-N
Molecular Weight 427.251 g/mol
SMILES [C@@](OC(=O)C)([C@@](OC(=O)C)(\C=C\N=N\c1ccc(cc1)Br)[H])(COC(=O)C)[H]
SPLASH splash10-114u-1490000000-1fab7bcee3566cde8afe
Source of Spectrum QC-6-954-20
Wiley ID 868800