| SpectraBase Spectrum ID |
7SUnKAyBqCa |
| Name |
5MT-NB3OMe 2TFA |
| Classification |
Designer drug |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
502.132726106 u |
| Formula |
C23H20N2O4F6 |
| InChI |
InChI=1S/C23H20F6N2O4/c1-34-16-5-3-4-14(10-16)12-30(20(32)22(24,25)26)9-8-15-13-31(21(33)23(27,28)29)19-7-6-17(35-2)11-18(15)19/h3-7,10-11,13H,8-9,12H2,1-2H3 |
| InChIKey |
CZWWHBDLIJWKPS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
502.413 g/mol |
| SMILES |
c1(cc2c(CCN(C(=O)C(F)(F)F)Cc3cccc(c3)OC)c[n](c2cc1)C(=O)C(F)(F)F)OC |
| SPLASH |
splash10-0avi-2790000000-97f464f73a3e6fe11ac4 |
| 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_9942 |
