SpectraBase Compound ID | WkeNV7wqca |
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InChI | InChI=1S/C10H19NO4/c1-4-7-11-8(10(13)15-3)5-6-9(12)14-2/h8,11H,4-7H2,1-3H3 |
InChIKey | BYFFQJIMZYJVMK-UHFFFAOYSA-N |
Mol Weight | 217.26 g/mol |
Molecular Formula | C10H19NO4 |
Exact Mass | 217.131408 g/mol |
SpectraBase Spectrum ID | H5tcq18ZJNp |
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Name | L-Glutamic acid, N-(N-propyl)-, dimethyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 217.131408092 u |
Formula | C10H19NO4 |
InChI | InChI=1S/C10H19NO4/c1-4-7-11-8(10(13)15-3)5-6-9(12)14-2/h8,11H,4-7H2,1-3H3 |
InChIKey | BYFFQJIMZYJVMK-UHFFFAOYSA-N |
Molecular Weight | 217.265 g/mol |
SMILES | COC(CCC(C(OC)=O)NCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.952399 |