| SpectraBase Spectrum ID |
JH1ICeOjLg1 |
| Name |
(1R,3S)-2-Benzyl-7-iodo-6-methoxy-1,3-dimethyl-1,2,3,4-tetrahydroisoquinolin-8-ol |
| Appearance |
Light brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.069523950 u |
| Formula |
C19H22INO2 |
| InChI |
InChI=1S/C19H22INO2/c1-12-9-15-10-16(23-3)18(20)19(22)17(15)13(2)21(12)11-14-7-5-4-6-8-14/h4-8,10,12-13,22H,9,11H2,1-3H3/t12-,13+/m0/s1 |
| InChIKey |
ONFUDIATGKEPCP-QWHCGFSZSA-N |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201600701 |
| Molecular Weight |
423.294 g/mol |
| Optical Rotation |
[a]D20 = +40.1 (c = 0.30, CH2Cl2) |
| Quality |
137 |
| Reported Formula |
C19H22INO2 |
| SMILES |
OC1=C(C(=CC2=C1[C@](N(CC1=CC=CC=C1)[C@](C2)(C)[H])(C)[H])OC)I |
| SPLASH |
splash10-0a4m-9730700000-0226116b827703d4687d |
| Source of Spectrum |
QE-22-SM11-7b (DOI: 10.1002/chem.201600701) |
| Wiley ID |
1904916 |
