| SpectraBase Spectrum ID |
2ewM8Vfrng |
| Name |
(1R,2R)-1-(4-hydroxybenzyl)-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-6,7-diol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO4 |
| InChI |
InChI=1S/C17H19NO4/c1-18(22)7-6-12-9-16(20)17(21)10-14(12)15(18)8-11-2-4-13(19)5-3-11/h2-5,9-10,15,19-21H,6-8H2,1H3/t15-,18-/m1/s1 |
| InChIKey |
NBVMNDIZMDPDMC-CRAIPNDOSA-N |
| Molecular Weight |
301.342 g/mol |
| SMILES |
Oc1cc2[C@@](Cc3ccc(cc3)O)([N@@+](CCc2cc1O)([O-])C)[H] |
| SPLASH |
splash10-002f-0790000000-db2e39bde5376b9ec932 |
| Source of Spectrum |
G4-62-1027-2 |
| Synonyms |
(1R,2R)-1-[(4-hydroxyphenyl)methyl]-2-methyl-2-oxidanidyl-3,4-dihydro-1H-isoquinolin-2-ium-6,7-diol
(1R,2R)-1-[(4-hydroxyphenyl)methyl]-2-methyl-2-oxido-3,4-dihydro-1H-isoquinolin-2-ium-6,7-diol |
| Wiley ID |
1607967 |
