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3-[[2-(4-Azidotetrafluorobenzamido)ethyl]dithio]propanoic acid
SpectraBase Compound ID EYbwTTAGk4i
InChI InChI=1S/C12H10F4N4O3S2/c13-7-6(8(14)10(16)11(9(7)15)19-20-17)12(23)18-2-4-25-24-3-1-5(21)22/h1-4H2,(H,18,23)(H,21,22)
InChIKey WGVMMTKVRGZTAV-UHFFFAOYSA-N
Mol Weight 398.35 g/mol
Molecular Formula C12H10F4N4O3S2
Exact Mass 398.013045 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5DZsj6nqGO
Name 3-[[2-(4-Azidotetrafluorobenzamido)ethyl]dithio]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F4N4O3S2
InChI InChI=1S/C12H10F4N4O3S2/c13-7-6(8(14)10(16)11(9(7)15)19-20-17)12(23)18-2-4-25-24-3-1-5(21)22/h1-4H2,(H,18,23)(H,21,22)
InChIKey WGVMMTKVRGZTAV-UHFFFAOYSA-N
Molecular Weight 398.351 g/mol
SMILES N(C(c1c(c(F)c(c(c1F)F)N=[N+]=[N-])F)=O)CCSSCCC(=O)O
SPLASH splash10-03di-4590000000-874178152efdb316e291
Source of Spectrum C3-21-518-7
Synonyms 3-({2-[(4-azido-2,3,5,6-tetrafluorobenzoyl)amino]ethyl}disulfanyl)propanoic acid 3-[[2-(4-Azido-2,3,5,6-tetrafluorobenzamido)ethyl]dithio]propanoic acid
Wiley ID 879508