SpectraBase Spectrum ID |
9Kex7yYiIdq |
Name |
(1R,2R)-2-((1R)-1-{[(1R)-1-phenylethyl]amino}ethyl)-1,2,3,4-tetrahydronaphthalen-1-ol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
295.193614428 u |
Formula |
C20H25NO |
InChI |
InChI=1S/C20H25NO/c1-14(16-8-4-3-5-9-16)21-15(2)18-13-12-17-10-6-7-11-19(17)20(18)22/h3-11,14-15,18,20-22H,12-13H2,1-2H3/t14-,15-,18-,20-/m1/s1 |
InChIKey |
GRIKXALPEPWEJJ-YZDADXEPSA-N |
SMILES |
[C@@]1([C@](C=2C=CC=CC2CC1)(O)[H])([C@](N[C@@](C=1C=CC=CC1)(C)[H])(C)[H])[H] |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.803614 |