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Nateglinide me P1103

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

Nateglinide me P1103
SpectraBase Compound ID EpH58HMnWNa
InChI InChI=1S/C20H29NO3/c1-14(2)16-9-11-17(12-10-16)19(22)21-18(20(23)24-3)13-15-7-5-4-6-8-15/h4-8,14,16-18H,9-13H2,1-3H3,(H,21,22)
InChIKey LUSNEIVFFXOKHW-UHFFFAOYSA-N
Mol Weight 331.46 g/mol
Molecular Formula C20H29NO3
Exact Mass 331.214744 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID v90AqR98EE
Name Nateglinide me P1103
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 331.214743795 u
Formula C20H29NO3
InChI InChI=1S/C20H29NO3/c1-14(2)16-9-11-17(12-10-16)19(22)21-18(20(23)24-3)13-15-7-5-4-6-8-15/h4-8,14,16-18H,9-13H2,1-3H3,(H,21,22)
InChIKey LUSNEIVFFXOKHW-UHFFFAOYSA-N
Molecular Weight 331.456 g/mol
SMILES C1C(C(C)C)CCC(C1)C(=O)NC(CC1=CC=CC=C1)C(=O)OC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.931149