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2-(2,4-di-Tert-pentylphenoxy)-2'-hydroxybutyranilide
SpectraBase Compound ID Cy2mXK7rDz1
InChI InChI=1S/C26H37NO3/c1-8-22(24(29)27-20-13-11-12-14-21(20)28)30-23-16-15-18(25(4,5)9-2)17-19(23)26(6,7)10-3/h11-17,22,28H,8-10H2,1-7H3,(H,27,29)
InChIKey DRASEWIGHUWNGB-UHFFFAOYSA-N
Mol Weight 411.6 g/mol
Molecular Formula C26H37NO3
Exact Mass 411.277344 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EkM9syZXZMN
Name 2-(2,4-di-Tert-pentylphenoxy)-2'-hydroxybutyranilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 411.277344052 u
Formula C26H37NO3
InChI InChI=1S/C26H37NO3/c1-8-22(24(29)27-20-13-11-12-14-21(20)28)30-23-16-15-18(25(4,5)9-2)17-19(23)26(6,7)10-3/h11-17,22,28H,8-10H2,1-7H3,(H,27,29)
InChIKey DRASEWIGHUWNGB-UHFFFAOYSA-N
Molecular Weight 411.586 g/mol
Nominal Mass 411 u
SMILES C1(=C(NC(=O)C(CC)OC2=CC=C(C=C2C(C)(CC)C)C(C)(C)CC)C=CC=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954084