| SpectraBase Compound ID | EmTIJvhRcNn |
|---|---|
| InChI | InChI=1S/C16H19NO4/c1-3-4-9-21-16(19)17-11-12(10-15(18)20-2)13-7-5-6-8-14(13)17/h5-8,11H,3-4,9-10H2,1-2H3 |
| InChIKey | XUUZJQHOGUCCDD-UHFFFAOYSA-N |
| Mol Weight | 289.33 g/mol |
| Molecular Formula | C16H19NO4 |
| Exact Mass | 289.131408 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8Z35jDUOQ1w |
|---|---|
| Name | |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C16H19NO4 |
| InChI | InChI=1S/C16H19NO4/c1-3-4-9-21-16(19)17-11-12(10-15(18)20-2)13-7-5-6-8-14(13)17/h5-8,11H,3-4,9-10H2,1-2H3 |
| InChIKey | XUUZJQHOGUCCDD-UHFFFAOYSA-N |
| Molecular Weight | 289.1309 |
| SMILES | c1cc2c(CC(OC)=O)c[n](C(=O)OCCCC)c2cc1 |
| SPLASH | splash10-003r-9830000000-1e3387dac3e649e6cc20 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |