| SpectraBase Spectrum ID |
8H6o6HQ7IrQ |
| Name |
Thebaol |
| CAS Registry Number |
481-81-2 |
| Classification |
Heroin impurity |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
254.094294308 u |
| Formula |
C16H14O3 |
| InChI |
InChI=1S/C16H14O3/c1-18-12-7-5-10-3-4-11-6-8-14(19-2)16(17)15(11)13(10)9-12/h3-9,17H,1-2H3 |
| InChIKey |
GKDSKCYMUUXQLA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
254.285 g/mol |
| Nominal Mass |
254 u |
| Quality |
899 |
| Retention Index |
1933 |
| SMILES |
OC=1C=2C3=C(C=CC2C=CC1OC)C=CC(=C3)OC |
| SPLASH |
splash10-0f79-3890000000-ef9d8da8957ce2f728b8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3,6-Dimethoxyphenanthren-4-ol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014131 |
