SpectraBase Compound ID | DPeKuiwC9TJ |
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InChI | InChI=1S/C9H11NO3.ClH.H2O/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;;/h2-4,10-12H,5H2,1H3;1H;1H2 |
InChIKey | BMLBCKUUKRDXCW-UHFFFAOYSA-N |
Mol Weight | 235.67 g/mol |
Molecular Formula | C9H14ClNO4 |
Exact Mass | 235.061136 g/mol |
SpectraBase Spectrum ID | 5k1zpm61z |
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Name | 3',4'-dihydroxy-2-(methylamino)acetophenone, hydrochloride, hydrate |
Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C9H14ClNO4 |
InChI | InChI=1S/C9H11NO3.ClH.H2O/c1-10-5-9(13)6-2-3-7(11)8(12)4-6;;/h2-4,10-12H,5H2,1H3;1H;1H2 |
InChIKey | BMLBCKUUKRDXCW-UHFFFAOYSA-N |
Instrument Name | Varian CFT-20 |
Sadtler NMR Number | 61539M |
Solvent | DMSO-d6 |