| SpectraBase Spectrum ID |
JF9Fb3Amnqa |
| Name |
Bornaprine-M (OH) AC II |
| Classification |
Pharmaceutical drug metabolite derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
387.240958543 u |
| Formula |
C23H33NO4 |
| InChI |
InChI=1S/C23H33NO4/c1-4-24(5-2)12-7-13-27-22(26)23(16-18-10-11-20(23)14-18)19-8-6-9-21(15-19)28-17(3)25/h6,8-9,15,18,20H,4-5,7,10-14,16H2,1-3H3 |
| InChIKey |
BVPAWMPSCFJNLQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
387.520 g/mol |
| Nominal Mass |
387 u |
| Quality |
921 |
| Retention Index |
2928 |
| SMILES |
C1(C2CC(C1)CC2)(C=1C=C(C=CC1)OC(=O)C)C(OCCCN(CC)CC)=O |
| SPLASH |
splash10-000i-9200000000-e372138c6b2cd40eb7fb |
| Sample Comments |
Acetyl position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-(diethylamino)propyl 2-(3-(acetyloxy)phenyl)bicyclo[2.2.1]heptane-2-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009294 |
