| SpectraBase Spectrum ID |
2klESwKtEtk |
| Name |
Isobutyl-3,4-methylenedioxy benzoate |
| Classification |
Designer drug side product |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
222.089208927 u |
| Formula |
C12H14O4 |
| InChI |
InChI=1S/C12H14O4/c1-8(2)6-14-12(13)9-3-4-10-11(5-9)16-7-15-10/h3-5,8H,6-7H2,1-2H3 |
| InChIKey |
NQAZSYLIZHQVQH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
222.240 g/mol |
| Nominal Mass |
222 u |
| Quality |
985 |
| Retention Index |
1680 |
| SMILES |
C1=2C(=CC=C(C2)C(OCC(C)C)=O)OCO1 |
| SPLASH |
splash10-02ta-9500000000-6b0e5bb4fdefdc7b74ce |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-Methylpropyl 1,3-benzodioxole-5-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014933 |
