| SpectraBase Spectrum ID |
2lhX0w1w2Yy |
| Name |
TDIQ AC |
| Classification |
Isoquinoline designer drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
219.089543280 u |
| Formula |
C12H13NO3 |
| InChI |
InChI=1S/C12H13NO3/c1-8(14)13-3-2-9-4-11-12(16-7-15-11)5-10(9)6-13/h4-5H,2-3,6-7H2,1H3 |
| InChIKey |
PVKXGJQEIZWVMG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
219.240 g/mol |
| Nominal Mass |
219 u |
| Quality |
942 |
| Retention Index |
1730 |
| SMILES |
C12=C(C=C3C(=C2)OCO3)CCN(C1)C(=O)C |
| SPLASH |
splash10-02bb-2930000000-d6a3a2fb3629dac71e7d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
MDTHIQ AC
1-(7,8-Dihydro[1,3]dioxolo[4,5-g]isoquinolin-6(5H)yl)ethanone |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018697 |
