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(1R,2S)-cis-1-[N-(2(S)-Amino-1-oxo-3-phenyl)propyl]amino-2-hydroxy-1,2,3,4-tetrahydronaphthalene
SpectraBase Compound ID HFEKYako1qQ
InChI InChI=1S/C19H22N2O2/c20-16(12-13-6-2-1-3-7-13)19(23)21-18-15-9-5-4-8-14(15)10-11-17(18)22/h1-9,16-18,22H,10-12,20H2,(H,21,23)/t16-,17-,18+/m0/s1
InChIKey YVRURIURUIUWBY-OKZBNKHCSA-N
Mol Weight 310.4 g/mol
Molecular Formula C19H22N2O2
Exact Mass 310.168128 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID HxJCqyECT1O
Name (1R,2S)-cis-1-[N-(2(S)-Amino-1-oxo-3-phenyl)propyl]amino-2-hydroxy-1,2,3,4-tetrahydronaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 310.168127954 u
Formula C19H22N2O2
InChI InChI=1S/C19H22N2O2/c20-16(12-13-6-2-1-3-7-13)19(23)21-18-15-9-5-4-8-14(15)10-11-17(18)22/h1-9,16-18,22H,10-12,20H2,(H,21,23)/t16-,17-,18+/m0/s1
InChIKey YVRURIURUIUWBY-OKZBNKHCSA-N
Molecular Weight 310.397 g/mol
SMILES [C@]1(NC([C@](CC=2C=CC=CC2)(N)[H])=O)(C2=C(C=CC=C2)CC[C@@]1(O)[H])[H]
Spectrum/Structure Validation Score (Vapor Phase IR) 0.882698