| SpectraBase Spectrum ID |
6jMYtgt7xEM |
| Name |
Bornaprine-M isomer-3 2AC |
| Classification |
Antiparkinsonian |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
401.220223097 u |
| Formula |
C23H31NO5 |
| InChI |
InChI=1S/C23H31NO5/c1-4-24(16(2)25)12-5-13-28-22(27)23(15-18-6-7-20(23)14-18)19-8-10-21(11-9-19)29-17(3)26/h8-11,18,20H,4-7,12-15H2,1-3H3 |
| InChIKey |
KDCHUBASHZWBCS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
401.503 g/mol |
| SMILES |
c1cc(OC(C)=O)ccc1C1(CC2CCC1C2)C(=O)OCCCN(C(C)=O)CC |
| SPLASH |
splash10-0a6u-7900000000-005c4ba7671d46e45ac7 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Synonyms |
Bornaprine-M (deethyl-HO-) isomer-3 2AC |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_918 |
