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(Z)-3-[(2-Aminoethyl)thio]-4,4,5,5,6,6-hexafluoro-2-hexenoic acid
SpectraBase Compound ID 4nSrT25qJaD
InChI InChI=1S/C8H9F6NO2S/c9-6(10)8(13,14)7(11,12)4(3-5(16)17)18-2-1-15/h3,6H,1-2,15H2,(H,16,17)/b4-3-
InChIKey CRIMPKQNSNKLKX-ARJAWSKDSA-N
Mol Weight 297.22 g/mol
Molecular Formula C8H9F6NO2S
Exact Mass 297.025819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ypIG3PHHaL
Name (Z)-3-[(2-Aminoethyl)thio]-4,4,5,5,6,6-hexafluoro-2-hexenoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9F6NO2S
InChI InChI=1S/C8H9F6NO2S/c9-6(10)8(13,14)7(11,12)4(3-5(16)17)18-2-1-15/h3,6H,1-2,15H2,(H,16,17)/b4-3-
InChIKey CRIMPKQNSNKLKX-ARJAWSKDSA-N
Molecular Weight 297.215 g/mol
SMILES NCCS\C(=C/C(=O)O)C(C(C(F)F)(F)F)(F)F
SPLASH splash10-001i-0290000000-f127153a5c4e0104e165
Source of Spectrum AJ-67-3027-6
Synonyms (2Z)-3-[(2-aminoethyl)sulfanyl]-4,4,5,5,6,6-hexafluoro-2-hexenoic acid
Wiley ID 772888