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2,4-Diacetylglutaranilide

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 Raman

2,4-Diacetylglutaranilide
SpectraBase Compound ID CKcGGp7kLZJ
InChI InChI=1S/C21H22N2O4/c1-14(24)18(20(26)22-16-9-5-3-6-10-16)13-19(15(2)25)21(27)23-17-11-7-4-8-12-17/h3-12,18-19H,13H2,1-2H3,(H,22,26)(H,23,27)
InChIKey XFOLUDAVXMIUDC-UHFFFAOYSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FzkdRQ0zO5C
Name 2,4-Diacetylglutaranilide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.157957192 u
Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c1-14(24)18(20(26)22-16-9-5-3-6-10-16)13-19(15(2)25)21(27)23-17-11-7-4-8-12-17/h3-12,18-19H,13H2,1-2H3,(H,22,26)(H,23,27)
InChIKey XFOLUDAVXMIUDC-UHFFFAOYSA-N
Molecular Weight 366.417 g/mol
SMILES N(C1=CC=CC=C1)C(C(CC(C(NC=1C=CC=CC1)=O)C(C)=O)C(C)=O)=O
Spectrum/Structure Validation Score (Raman) 0.974917