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Glycine, N-methoxycarbonyl-, heptadecyl ester

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

Glycine, N-methoxycarbonyl-, heptadecyl ester
SpectraBase Compound ID HSExoA5goEj
InChI InChI=1S/C21H41NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-20(23)19-22-21(24)25-2/h3-19H2,1-2H3,(H,22,24)
InChIKey JMUMOAQUSKZKCP-UHFFFAOYSA-N
Mol Weight 371.6 g/mol
Molecular Formula C21H41NO4
Exact Mass 371.303559 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Kr4NMRTE5h4
Name Glycine, N-methoxycarbonyl-, heptadecyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.303558800 u
Formula C21H41NO4
InChI InChI=1S/C21H41NO4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-26-20(23)19-22-21(24)25-2/h3-19H2,1-2H3,(H,22,24)
InChIKey JMUMOAQUSKZKCP-UHFFFAOYSA-N
Molecular Weight 371.562 g/mol
SMILES COC(NCC(OCCCCCCCCCCCCCCCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.906225