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Ethyl 2-fluoro-2-(1-methyl-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)acetate
SpectraBase Compound ID 9E96JXlHuRz
InChI InChI=1S/C7H10FN3O2S/c1-3-13-6(12)5(8)11-4-9-10(2)7(11)14/h4-5H,3H2,1-2H3
InChIKey BORVRMRULAQDMC-UHFFFAOYSA-N
Mol Weight 219.23 g/mol
Molecular Formula C7H10FN3O2S
Exact Mass 219.047776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2stauRml3Ta
Name Ethyl 2-fluoro-2-(1-methyl-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10FN3O2S
InChI InChI=1S/C7H10FN3O2S/c1-3-13-6(12)5(8)11-4-9-10(2)7(11)14/h4-5H,3H2,1-2H3
InChIKey BORVRMRULAQDMC-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201801166
Molecular Weight 219.234 g/mol
SMILES C(C)OC(C(N1C=NN(C1=S)C)F)=O
SPLASH splash10-00kb-4890000000-7d3fc60f75aa8c477ee7
Source of Spectrum ASC-360-4804-37
Wiley ID 1812253