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Isopropyl dl-N,N-dimethylphenylalanine ester

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Isopropyl dl-N,N-dimethylphenylalanine ester
SpectraBase Compound ID 5LtXD57X9CV
InChI InChI=1S/C14H21NO2/c1-11(2)17-14(16)13(15(3)4)10-12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3
InChIKey TULUMOLCIDGEBS-UHFFFAOYSA-N
Mol Weight 235.33 g/mol
Molecular Formula C14H21NO2
Exact Mass 235.157229 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID KacyUTPAFDz
Name Isopropyl dl-N,N-dimethylphenylalanine ester
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 235.157228918 u
Formula C14H21NO2
InChI InChI=1S/C14H21NO2/c1-11(2)17-14(16)13(15(3)4)10-12-8-6-5-7-9-12/h5-9,11,13H,10H2,1-4H3
InChIKey TULUMOLCIDGEBS-UHFFFAOYSA-N
Molecular Weight 235.327 g/mol
SMILES C(C(N(C)C)CC1=CC=CC=C1)(OC(C)C)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.955264