SpectraBase Compound ID | 9O7cLDUg6mB |
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InChI | InChI=1S/C12H9BrO.C6H3N3O7/c1-8(14)9-6-7-12(13)11-5-3-2-4-10(9)11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-7H,1H3;1-2,10H |
InChIKey | SSWMJSOOERNRSJ-UHFFFAOYSA-N |
Mol Weight | 478.21 g/mol |
Molecular Formula | C18H12BrN3O8 |
Exact Mass | 476.980777 g/mol |
SpectraBase Spectrum ID | 2k5wh2rePXK |
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Name | 4'-bromo-1'-acetonaphthone, monopicrate |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C18H12BrN3O8 |
InChI | InChI=1S/C12H9BrO.C6H3N3O7/c1-8(14)9-6-7-12(13)11-5-3-2-4-10(9)11;10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16/h2-7H,1H3;1-2,10H |
InChIKey | SSWMJSOOERNRSJ-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 35379M |
Solvent | CDCl3 |