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L-Alanine, N-allyloxycarbonyl-, propyl ester

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L-Alanine, N-allyloxycarbonyl-, propyl ester
SpectraBase Compound ID JmVg0lQD4cS
InChI InChI=1S/C10H17NO4/c1-4-6-14-9(12)8(3)11-10(13)15-7-5-2/h5,8H,2,4,6-7H2,1,3H3,(H,11,13)
InChIKey NKBIFLFRFVHHRS-UHFFFAOYSA-N
Mol Weight 215.25 g/mol
Molecular Formula C10H17NO4
Exact Mass 215.115758 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID FGa4sbnzBcn
Name L-Alanine, N-allyloxycarbonyl-, propyl ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 215.115758027 u
Formula C10H17NO4
InChI InChI=1S/C10H17NO4/c1-4-6-14-9(12)8(3)11-10(13)15-7-5-2/h5,8H,2,4,6-7H2,1,3H3,(H,11,13)
InChIKey NKBIFLFRFVHHRS-UHFFFAOYSA-N
Molecular Weight 215.249 g/mol
SMILES C=CCOC(NC(C)C(OCCC)=O)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.826352