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3-Aminobutyric acid, N-isobutoxycarbonyl-, ethyl ester

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

3-Aminobutyric acid, N-isobutoxycarbonyl-, ethyl ester
SpectraBase Compound ID Ih29lVER40
InChI InChI=1S/C11H21NO4/c1-5-15-10(13)6-9(4)12-11(14)16-7-8(2)3/h8-9H,5-7H2,1-4H3,(H,12,14)
InChIKey ZCRZTTSCTBVSOM-UHFFFAOYSA-N
Mol Weight 231.29 g/mol
Molecular Formula C11H21NO4
Exact Mass 231.147058 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3P2UTZp8U6m
Name 3-Aminobutyric acid, N-isobutoxycarbonyl-, ethyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 231.147058156 u
Formula C11H21NO4
InChI InChI=1S/C11H21NO4/c1-5-15-10(13)6-9(4)12-11(14)16-7-8(2)3/h8-9H,5-7H2,1-4H3,(H,12,14)
InChIKey ZCRZTTSCTBVSOM-UHFFFAOYSA-N
Molecular Weight 231.292 g/mol
SMILES CC(COC(NC(C)CC(OCC)=O)=O)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.956661