| SpectraBase Spectrum ID |
8ICWL54XK3U |
| Name |
Pentyl-3,4-methylenedioxy benzoate |
| Classification |
Designer drug side product |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
236.104858991 u |
| Formula |
C13H16O4 |
| InChI |
InChI=1S/C13H16O4/c1-2-3-4-7-15-13(14)10-5-6-11-12(8-10)17-9-16-11/h5-6,8H,2-4,7,9H2,1H3 |
| InChIKey |
XPEOHIAAULZCNY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
236.267 g/mol |
| Nominal Mass |
236 u |
| Quality |
984 |
| Retention Index |
1812 |
| SMILES |
C1=2C(=CC=C(C2)C(OCCCCC)=O)OCO1 |
| SPLASH |
splash10-014i-3900000000-32bae23a424f9d3a9d70 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3,4-Methylenedioxybenzoate,pentyl
Pentyl-1,3-benzodioxole-5-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010351 |
