SpectraBase Compound ID | 4t97t6zkQEZ |
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InChI | InChI=1S/C19H29NO3/c1-3-5-11-16-23-19(22)15-10-9-14-18(21)20(4-2)17-12-7-6-8-13-17/h6-8,12-13H,3-5,9-11,14-16H2,1-2H3 |
InChIKey | ZWFXNCMYVMJNKK-UHFFFAOYSA-N |
Mol Weight | 319.45 g/mol |
Molecular Formula | C19H29NO3 |
Exact Mass | 319.214744 g/mol |
SpectraBase Spectrum ID | BqHElFTGEqB |
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Name | Adipic acid, monoamide, N-ethyl-N-phenyl-, pentyl ester |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 319.214743795 u |
Formula | C19H29NO3 |
InChI | InChI=1S/C19H29NO3/c1-3-5-11-16-23-19(22)15-10-9-14-18(21)20(4-2)17-12-7-6-8-13-17/h6-8,12-13H,3-5,9-11,14-16H2,1-2H3 |
InChIKey | ZWFXNCMYVMJNKK-UHFFFAOYSA-N |
Molecular Weight | 319.445 g/mol |
SMILES | C(CC(=O)N(CC)C1=CC=CC=C1)CCC(OCCCCC)=O |