| SpectraBase Spectrum ID |
KkY5WylwAAz |
| Name |
Tapentadol-M (nor-methoxy-) 2AC |
| Classification |
Potent analgesic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
321.194008349 u |
| Formula |
C18H27NO4 |
| InChI |
InChI=1S/C18H27NO4/c1-7-18(12(2)11-19(5)13(3)20)15-8-16(22-6)10-17(9-15)23-14(4)21/h8-10,12,18H,7,11H2,1-6H3 |
| InChIKey |
OJYJNMCSAPSALQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
321.417 g/mol |
| SMILES |
c1(cc(cc(c1)OC)C(C(CN(C(=O)C)C)C)CC)OC(=O)C |
| SPLASH |
splash10-00kr-3920000000-edc00aff7e18ac589a5c |
| 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 |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_8714 |
