| SpectraBase Spectrum ID |
HJf371y4fUX |
| Name |
Pentazocine TFA |
| Classification |
Potent analgesic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
381.191563568 u |
| Formula |
C21H26F3NO2 |
| InChI |
InChI=1S/C21H26F3NO2/c1-13(2)7-9-25-10-8-20(4)14(3)18(25)11-15-5-6-16(12-17(15)20)27-19(26)21(22,23)24/h5-7,12,14,18H,8-11H2,1-4H3 |
| InChIKey |
FZRVSZGDHBPVBY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
381.439 g/mol |
| SMILES |
C12(c3c(ccc(OC(C(F)(F)F)=O)c3)CC(C1C)N(CC=C(C)C)CC2)C |
| SPLASH |
splash10-02t9-9624000000-33e25ce8843a0f9728eb |
| 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. |
| 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_4007 |
