| SpectraBase Compound ID | BRR4zqb3J0L |
|---|---|
| InChI | InChI=1S/C13H21NO2/c1-4-5-6-8-12-9-7-10-14(12)11(2)13(15)16-3/h7,9-11H,4-6,8H2,1-3H3 |
| InChIKey | SMKMQUKCGVPSGR-UHFFFAOYSA-N |
| Mol Weight | 223.32 g/mol |
| Molecular Formula | C13H21NO2 |
| Exact Mass | 223.157229 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 47tZlCHWUh2 |
|---|---|
| Name | Methyl 2-(2'-pentyl-1H-pyrrol-1'-yl)-propanoate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H21NO2 |
| InChI | InChI=1S/C13H21NO2/c1-4-5-6-8-12-9-7-10-14(12)11(2)13(15)16-3/h7,9-11H,4-6,8H2,1-3H3 |
| InChIKey | SMKMQUKCGVPSGR-UHFFFAOYSA-N |
| Molecular Weight | 223.316 g/mol |
| SMILES | C([n]1c(ccc1)CCCCC)(C(=O)OC)C |
| SPLASH | splash10-066r-1910000000-554a4127721411aa8f33 |
| Source of Spectrum | CRT-18-346-8aS |
| Wiley ID | 1710124 |