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3-Amino-pentanoic acid, N-ethoxycarbonyl-, methyl ester

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

3-Amino-pentanoic acid, N-ethoxycarbonyl-, methyl ester
SpectraBase Compound ID FuVIj4Djx15
InChI InChI=1S/C9H17NO4/c1-4-7(6-8(11)13-3)10-9(12)14-5-2/h7H,4-6H2,1-3H3,(H,10,12)
InChIKey VEAQNMOIAIMQNZ-UHFFFAOYSA-N
Mol Weight 203.24 g/mol
Molecular Formula C9H17NO4
Exact Mass 203.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID AMITDG1vkBk
Name 3-Amino-pentanoic acid, N-ethoxycarbonyl-, methyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.115758027 u
Formula C9H17NO4
InChI InChI=1S/C9H17NO4/c1-4-7(6-8(11)13-3)10-9(12)14-5-2/h7H,4-6H2,1-3H3,(H,10,12)
InChIKey VEAQNMOIAIMQNZ-UHFFFAOYSA-N
Molecular Weight 203.238 g/mol
SMILES CCC(CC(OC)=O)NC(OCC)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.963105