![3,4-dihydoxy-a-{{[a-methyl-3,4-(methylenedioxy)phenethyl]amino}methyl}benzyl alcohol, hydrochloride](/api/spectrum/DBNHiyvK9Fg/structure.png?h=300&w=458 "3,4-dihydoxy-a-{{[a-methyl-3,4-(methylenedioxy)phenethyl]amino}methyl}benzyl alcohol, hydrochloride")
| SpectraBase Compound ID | 3AVSKAt3GxH |
|---|---|
| InChI | InChI=1S/C18H21NO5.ClH/c1-11(6-12-2-5-17-18(7-12)24-10-23-17)19-9-16(22)13-3-4-14(20)15(21)8-13;/h2-5,7-8,11,16,19-22H,6,9-10H2,1H3;1H |
| InChIKey | LOVXREQUMZKFCM-UHFFFAOYSA-N |
| Mol Weight | 367.83 g/mol |
| Molecular Formula | C18H22ClNO5 |
| Exact Mass | 367.118651 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | DBNHiyvK9Fg |
|---|---|
| Name | 3,4-dihydoxy-a-{{[a-methyl-3,4-(methylenedioxy)phenethyl]amino}methyl}benzyl alcohol, hydrochloride |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H22ClNO5 |
| InChI | InChI=1S/C18H21NO5.ClH/c1-11(6-12-2-5-17-18(7-12)24-10-23-17)19-9-16(22)13-3-4-14(20)15(21)8-13;/h2-5,7-8,11,16,19-22H,6,9-10H2,1H3;1H |
| InChIKey | LOVXREQUMZKFCM-UHFFFAOYSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 31281M |
| Solvent | Polysol |