SpectraBase Spectrum ID |
4Ff8QLdb00h |
Name |
(R)-5-(Naphth-2-yl)-1,3-dimethyl-3,4-dihydroisoquinolin-8-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
301.146664235 u |
Formula |
C21H19NO |
InChI |
InChI=1S/C21H19NO/c1-13-11-19-18(9-10-20(23)21(19)14(2)22-13)17-8-7-15-5-3-4-6-16(15)12-17/h3-10,12-13,23H,11H2,1-2H3/t13-/m1/s1 |
InChIKey |
GVLGNVUQNHMAGA-CYBMUJFWSA-N |
SMILES |
C12=C(C(C)=N[C@@](C2)(C)[H])C(O)=CC=C1C=1C=C2C=CC=CC2=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.943722 |