| SpectraBase Spectrum ID |
2ngpCfeBpRY |
| Name |
Benzoctamine |
| CAS Registry Number |
17243-39-9 |
| Classification |
Pharmaceutical drug, tranquiliser |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
249.151749616 u |
| Formula |
C18H19N |
| InChI |
InChI=1S/C18H19N/c1-19-12-18-11-10-13(14-6-2-4-8-16(14)18)15-7-3-5-9-17(15)18/h2-9,13,19H,10-12H2,1H3 |
| InChIKey |
GNRXCIONJWKSEA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
249.357 g/mol |
| Nominal Mass |
249 u |
| Quality |
936 |
| Retention Index |
2082 |
| SMILES |
C12(C=3C(C(C4=C2C=CC=C4)CC1)=CC=CC3)CNC |
| SPLASH |
splash10-014l-2970000000-1c8653436728fcc42607 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Benzoctamin
Benzoctamina
Benzoctaminum
N-(9,10-Dihydro-9,10-ethano-anthracen-9-ylmethyl)methylamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_012114 |
