| SpectraBase Spectrum ID |
4TKcsRVT4S |
| Name |
Clofedanol-M (nor-HO-) -H2O 2AC |
| Classification |
Antitussive |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
357.113171205 u |
| Formula |
C20H20ClNO3 |
| InChI |
InChI=1S/C20H20ClNO3/c1-14(23)22(3)13-12-18(19-6-4-5-7-20(19)21)16-8-10-17(11-9-16)25-15(2)24/h4-12H,13H2,1-3H3/b18-12+ |
| InChIKey |
KEKMPBIVPTVWBR-LDADJPATSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
357.837 g/mol |
| SMILES |
c1(\C(=C/CN(C(C)=O)C)c2ccccc2Cl)ccc(OC(C)=O)cc1 |
| SPLASH |
splash10-0005-5591000000-21ace1b6d673ddd11be9 |
| 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: UHYAC |
| 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_1634 |
