| SpectraBase Spectrum ID |
2kPVYbV1PxA |
| Name |
RTI-111 A (-Cl2) |
| Classification |
Designer drug artifact |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
259.157228918 u |
| Formula |
C16H21NO2 |
| InChI |
InChI=1S/C16H21NO2/c1-17-12-8-9-14(17)15(16(18)19-2)13(10-12)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12-,13+,14+,15-/m0/s1 |
| InChIKey |
OMBOXYLBBHNWHL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
259.349 g/mol |
| Nominal Mass |
259 u |
| Quality |
996 |
| Retention Index |
2021 |
| SMILES |
[C@@]1([C@@]([C@@]2(N([C@](C1)(CC2)[H])C)[H])(C(OC)=O)[H])(C=1C=CC=CC1)[H] |
| SPLASH |
splash10-001i-9300000000-08c5231e3ebd98bdc6da |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Dichloropane-A (-Cl2)
Methyl 8-methyl-3-phenyl-8-azabicyclo[3.2.1]octane-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_024764 |
