SpectraBase Compound ID | LFXnzNimibi |
---|---|
InChI | InChI=1S/C13H16BrClN2S/c14-10-5-6-12(11(15)9-10)16-13(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2,(H,16,18) |
InChIKey | NXLJBTBBOPPQPV-UHFFFAOYSA-N |
Mol Weight | 347.7 g/mol |
Molecular Formula | C13H16BrClN2S |
Exact Mass | 345.99061 g/mol |
SpectraBase Spectrum ID | HHIQlh39QU2 |
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Name | 4'-bromo-2'-chlorohexahydrothio-1H-azepine-1-carboxanilide |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C13H16BrClN2S |
InChI | InChI=1S/C13H16BrClN2S/c14-10-5-6-12(11(15)9-10)16-13(18)17-7-3-1-2-4-8-17/h5-6,9H,1-4,7-8H2,(H,16,18) |
InChIKey | NXLJBTBBOPPQPV-UHFFFAOYSA-N |
Sadtler IR Number | 56315 |
Sadtler UV Number | 30699N |
Solvent | Methanol |