| SpectraBase Spectrum ID |
FbGWjegvuGU |
| Name |
5MT-NB3SMe HFB |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
522.121196237 u |
| Formula |
C23H21N2O2SF7 |
| InChI |
InChI=1S/C23H21F7N2O2S/c1-34-16-6-7-19-18(11-16)15(12-31-19)8-9-32(13-14-4-3-5-17(10-14)35-2)20(33)21(24,25)22(26,27)23(28,29)30/h3-7,10-12,31H,8-9,13H2,1-2H3 |
| InChIKey |
NJTXCJBCWBDEGV-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
522.482 g/mol |
| SMILES |
c1(ccc2c(c1)c(c[nH]2)CCN(C(=O)C(F)(F)C(F)(F)C(F)(F)F)Cc1cc(ccc1)SC)OC |
| SPLASH |
splash10-03di-0900000000-72f15d6255bbffaa2fde |
| 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_9987 |
