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(1R,2R)-2-((1R)-1-{[(1R)-1-phenylethyl]amino}ethyl)-1,2,3,4-tetrahydronaphthalen-1-ol
SpectraBase Compound ID Ijvn776Uz8d
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
Mol Weight 295.43 g/mol
Molecular Formula C20H25NO
Exact Mass 295.193614 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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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