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1,2,3,4-Tetrahydroisoquinolin-2-carboxylicacid amide, 1-[1-hydroxyethyl]-
SpectraBase Compound ID 7l3iA30FbJt
InChI InChI=1S/C22H28N2O4/c1-14(16-8-6-5-7-9-16)23-22(26)24-11-10-17-12-19(27-3)20(28-4)13-18(17)21(24)15(2)25/h5-9,12-15,21,25H,10-11H2,1-4H3,(H,23,26)
InChIKey FRAJUXBNJOIZOQ-UHFFFAOYSA-N
Mol Weight 384.48 g/mol
Molecular Formula C22H28N2O4
Exact Mass 384.204907 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 2m1nyHLLQVS
Name 1,2,3,4-Tetrahydroisoquinolin-2-carboxylicacid amide, 1-[1-hydroxyethyl]-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 384.204907386 u
Formula C22H28N2O4
InChI InChI=1S/C22H28N2O4/c1-14(16-8-6-5-7-9-16)23-22(26)24-11-10-17-12-19(27-3)20(28-4)13-18(17)21(24)15(2)25/h5-9,12-15,21,25H,10-11H2,1-4H3,(H,23,26)
InChIKey FRAJUXBNJOIZOQ-UHFFFAOYSA-N
Molecular Weight 384.476 g/mol
SMILES C1(=C(C=C2C(=C1)C(N(CC2)C(=O)NC(C)C1=CC=CC=C1)C(C)O)OC)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.813566