| SpectraBase Spectrum ID |
JRLmj3oLTuQ |
| Name |
Cocaine-M (HO-methoxy-) AC |
| Classification |
Local anesthetic
Addictive drug |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
391.163102142 u |
| Formula |
C20H25NO7 |
| InChI |
InChI=1S/C20H25NO7/c1-11(22)27-15-8-5-12(9-16(15)25-3)19(23)28-17-10-13-6-7-14(21(13)2)18(17)20(24)26-4/h5,8-9,13-14,17-18H,6-7,10H2,1-4H3 |
| InChIKey |
YCMFXXNIZYZGAZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
391.420 g/mol |
| SMILES |
CC(Oc1ccc(cc1OC)C(OC1CC2N(C(C1C(OC)=O)CC2)C)=O)=O |
| SPLASH |
splash10-001i-9701000000-3e6bdfe777630e36636c |
| 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: UGLUCAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_5944 |
