| SpectraBase Spectrum ID |
8JsSMfKJ5KC |
| Name |
Hydrocotarnine |
| CAS Registry Number |
550-10-7 |
| Classification |
Opium alkaloid |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
221.105193344 u |
| Formula |
C12H15NO3 |
| InChI |
InChI=1S/C12H15NO3/c1-13-4-3-8-5-10-12(16-7-15-10)11(14-2)9(8)6-13/h5H,3-4,6-7H2,1-2H3 |
| InChIKey |
XXANNZJIZQTCBP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
221.256 g/mol |
| Nominal Mass |
221 u |
| Quality |
977 |
| Retention Index |
1742 |
| SMILES |
C12=C(C3=C(C=C2CCN(C1)C)OCO3)OC |
| SPLASH |
splash10-00fr-3980000000-34d4624ffc68e0af4cca |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4-Methoxy-6-methyl-5,6,7,8-tetrahydro-1,3-dioxolo[4,5-g]isochinoline |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030391 |
