| SpectraBase Spectrum ID |
4xnrDuMqHY |
| Name |
Isofentanyl-M (alkyl-HO-) TFA |
| Classification |
Designer drug |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
448.197377223 u |
| Formula |
C24H27N2O3F3 |
| InChI |
InChI=1S/C24H27F3N2O3/c1-17-15-28(16-19-9-5-3-6-10-19)14-13-21(17)29(20-11-7-4-8-12-20)22(30)18(2)32-23(31)24(25,26)27/h3-12,17-18,21H,13-16H2,1-2H3 |
| InChIKey |
ZEMUVXRHKYROCW-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
448.486 g/mol |
| SMILES |
C(C(OC(C(N(c1ccccc1)C1CCN(Cc2ccccc2)CC1C)=O)C)=O)(F)(F)F |
| SPLASH |
splash10-0007-9200000000-bad9a2e476a6d83027d9 |
| 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: USPEAC |
| 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_8030 |
