| SpectraBase Compound ID | GVh42hfBItV |
|---|---|
| InChI | InChI=1S/C13H19NO4/c1-18-12(15)8-4-2-3-6-10(13(16)17)11-7-5-9-14-11/h5,7,9-10,14H,2-4,6,8H2,1H3,(H,16,17) |
| InChIKey | PBGZSZCKHGPXIU-UHFFFAOYSA-N |
| Mol Weight | 253.3 g/mol |
| Molecular Formula | C13H19NO4 |
| Exact Mass | 253.131408 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | yVAhNZhxhd |
|---|---|
| Name | 8-Methoxy-8-oxo-2-(1H-pyrrol-2-yl)octanoic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H19NO4 |
| InChI | InChI=1S/C13H19NO4/c1-18-12(15)8-4-2-3-6-10(13(16)17)11-7-5-9-14-11/h5,7,9-10,14H,2-4,6,8H2,1H3,(H,16,17) |
| InChIKey | PBGZSZCKHGPXIU-UHFFFAOYSA-N |
| Literature Reference DOI | 10.1039/C6RA05348C |
| Molecular Weight | 253.298 g/mol |
| SMILES | [nH]1c(C(C(O)=O)CCCCCC(OC)=O)ccc1 |
| SPLASH | splash10-001i-9100000000-156cabc133679093d52f |
| Source of Spectrum | RSA-6-44341/SM4-5ja |
| Wiley ID | 1807194 |