| SpectraBase Spectrum ID |
2xFyW4IQc9Q |
| Name |
(2S*,4R*)-2-(4-Methoxyphenyl)-1-methyl-1,2,3,4-tetrahydro-quinolin-4-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
269.141578854 u |
| Formula |
C17H19NO2 |
| InChI |
InChI=1S/C17H19NO2/c1-18-15-6-4-3-5-14(15)17(19)11-16(18)12-7-9-13(20-2)10-8-12/h3-10,16-17,19H,11H2,1-2H3/t16-,17+/m0/s1 |
| InChIKey |
JJSBKSPQSPMIKY-DLBZAZTESA-N |
| SMILES |
[C@]1(N(C2=CC=CC=C2[C@@](C1)(O)[H])C)(C1=CC=C(C=C1)OC)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946853 |
