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Propanamide, 3-[3,5-di(tert-butyl)-4-hydroxyphenyl]-N-(2-hydroxyethyl)-
SpectraBase Compound ID 9Z2naEG9Mtb
InChI InChI=1S/C19H31NO3/c1-18(2,3)14-11-13(7-8-16(22)20-9-10-21)12-15(17(14)23)19(4,5)6/h11-12,21,23H,7-10H2,1-6H3,(H,20,22)
InChIKey GHAQLQRXNCECQB-UHFFFAOYSA-N
Mol Weight 321.46 g/mol
Molecular Formula C19H31NO3
Exact Mass 321.230394 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID BGRFB7YBFBZ
Name Propanamide, 3-[3,5-di(tert-butyl)-4-hydroxyphenyl]-N-(2-hydroxyethyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 321.230393859 u
Formula C19H31NO3
InChI InChI=1S/C19H31NO3/c1-18(2,3)14-11-13(7-8-16(22)20-9-10-21)12-15(17(14)23)19(4,5)6/h11-12,21,23H,7-10H2,1-6H3,(H,20,22)
InChIKey GHAQLQRXNCECQB-UHFFFAOYSA-N
Molecular Weight 321.461 g/mol
SMILES C1(=C(C(C)(C)C)C=C(C=C1C(C)(C)C)CCC(=O)NCCO)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.81539