SpectraBase Spectrum ID |
AVpv5dkBMqN |
Name |
Sulfametopyrazine PFP |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
426.042116835 u |
Formula |
C14H11F5N4O4S |
InChI |
InChI=1S/C14H11F5N4O4S/c1-27-11-10(20-6-7-21-11)23-28(25,26)9-4-2-8(3-5-9)22-12(24)13(15,16)14(17,18)19/h2-7H,1H3,(H,20,23)(H,22,24) |
InChIKey |
FCCGOEXJCHSUCQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
426.318 g/mol |
Nominal Mass |
426 u |
Quality |
976 |
Retention Index |
2492 |
SMILES |
C1(NS(C2=CC=C(NC(C(C(F)(F)F)(F)F)=O)C=C2)(=O)=O)=C(N=CC=N1)OC |
SPLASH |
splash10-0ikc-9213000000-fbc0345dfb8bb9cb4406 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2,2,3,3,3-pentafluoro-N-(4-(((3-methoxy-1,4-diazin-2-yl)amino)sulfonyl)phenyl)propanamide |
Technique |
GC/MS |
Wiley ID |
DD2024_010257 |