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Aminoglutethimide AC

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

Aminoglutethimide AC
SpectraBase Compound ID AVBIuzMFzbf
InChI InChI=1S/C15H18N2O3/c1-3-15(9-8-13(19)17-14(15)20)11-4-6-12(7-5-11)16-10(2)18/h4-7H,3,8-9H2,1-2H3,(H,16,18)(H,17,19,20)
InChIKey PBWKSBSBPBMFIS-UHFFFAOYSA-N
Mol Weight 274.32 g/mol
Molecular Formula C15H18N2O3
Exact Mass 274.131742 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KetFClBoxPS
Name Aminoglutethimide monoacetamide (isomer 2)
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 274.131742445 u
Formula C15H18N2O3
InChI InChI=1S/C15H18N2O3/c1-3-15(9-8-13(19)17-14(15)20)11-4-6-12(7-5-11)16-10(2)18/h4-7H,3,8-9H2,1-2H3,(H,16,18)(H,17,19,20)
InChIKey PBWKSBSBPBMFIS-UHFFFAOYSA-N
SMILES C1(=O)NC(CCC1(C1=CC=C(C=C1)NC(C)=O)CC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.833484