| SpectraBase Spectrum ID |
8PHCHKHkvfy |
| Name |
3,6-Dimethoxy-4-acetoxy-5-[(2-N-methylacetamido)ethyl]phenanthrene |
| CAS Registry Number |
89469-84-1 |
| Classification |
Heroin ingredient |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
395.173272904 u |
| Formula |
C23H25NO5 |
| InChI |
InChI=1S/C23H25NO5/c1-14(25)24(3)13-12-18-19(27-4)10-8-16-6-7-17-9-11-20(28-5)23(29-15(2)26)22(17)21(16)18/h6-11H,12-13H2,1-5H3 |
| InChIKey |
BNNUJMGLZXKERQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
395.455 g/mol |
| Nominal Mass |
395 u |
| Quality |
929 |
| Retention Index |
2998 |
| SMILES |
C=12C3=C(C(=CC=C3C=CC1C=CC(=C2CCN(C(=O)C)C)OC)OC)OC(=O)C |
| SPLASH |
splash10-0uxr-0091000000-5c325a90a5f72a36becd |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3,6-Dimethoxy-4-acetoxy-5-(2-N-methylacetamido)ethylphenanthrene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014568 |
