| SpectraBase Spectrum ID |
3Q04BO2yGW |
| Name |
Pentazocine artifact (+H2O) AC6 |
| Classification |
Potent analgesic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
345.230393859 u |
| Formula |
C21H31NO3 |
| InChI |
InChI=1S/C21H31NO3/c1-14-19-12-16-6-7-17(25-15(2)23)13-18(16)21(14,5)9-11-22(19)10-8-20(3,4)24/h6-7,13-14,19,24H,8-12H2,1-5H3 |
| InChIKey |
XFJWWFGPEBFWQD-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
345.483 g/mol |
| SMILES |
c1cc2CC3N(CCC(O)(C)C)CCC(C)(c2cc1OC(=O)C)C3C |
| SPLASH |
splash10-00di-1291000000-0e6af964927d7e60f684 |
| 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_252 |
