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6-Nitro-2-(trifluoromethyl)benzo[b]thiophene
SpectraBase Compound ID GbhsFgVEapS
InChI InChI=1S/C9H4F3NO2S/c10-9(11,12)8-3-5-1-2-6(13(14)15)4-7(5)16-8/h1-4H
InChIKey ZZFJPHWANQIIBE-UHFFFAOYSA-N
Mol Weight 247.19 g/mol
Molecular Formula C9H4F3NO2S
Exact Mass 246.991484 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F5hETiqjxDE
Name 6-Nitro-2-(trifluoromethyl)benzo[b]thiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H4F3NO2S
InChI InChI=1S/C9H4F3NO2S/c10-9(11,12)8-3-5-1-2-6(13(14)15)4-7(5)16-8/h1-4H
InChIKey ZZFJPHWANQIIBE-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo101675f
Molecular Weight 247.191 g/mol
SMILES c1(cc2sc(cc2cc1)C(F)(F)F)[N+](=O)[O-]
SPLASH splash10-0fr2-1390000000-a9b3394d1a9fb4a0e235
Source of Spectrum J-75-7037/SMS5-8
Synonyms 6-Nitro-2-(trifluoromethyl)-1-benzothiophene
Wiley ID 1751829