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(Z)-3-(2-aminoethylsulfanyl)-4,4-difluoro-but-2-enoic acid
SpectraBase Compound ID 6QSZXLPPCoj
InChI InChI=1S/C6H9F2NO2S/c7-6(8)4(3-5(10)11)12-2-1-9/h3,6H,1-2,9H2,(H,10,11)/b4-3-
InChIKey ZTJBPMOYIHTPFU-ARJAWSKDSA-N
Mol Weight 197.2 g/mol
Molecular Formula C6H9F2NO2S
Exact Mass 197.032206 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KvxGiaZ0wUd
Name (Z)-3-(2-aminoethylsulfanyl)-4,4-difluoro-but-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H9F2NO2S
InChI InChI=1S/C6H9F2NO2S/c7-6(8)4(3-5(10)11)12-2-1-9/h3,6H,1-2,9H2,(H,10,11)/b4-3-
InChIKey ZTJBPMOYIHTPFU-ARJAWSKDSA-N
Molecular Weight 197.200 g/mol
SMILES NCCS\C(=C/C(=O)O)C(F)F
SPLASH splash10-03di-9400000000-d073ce16631dd3de96b9
Source of Spectrum AJ-67-3027-6
Synonyms (Z)-3-(2-aminoethylthio)-4,4-difluoro-but-2-enoic acid (Z)-3-(2-azanylethylsulfanyl)-4,4-bis(fluoranyl)but-2-enoic acid (Z)-3-(2-aminoethylthio)-4,4-difluoro-2-butenoic acid
Wiley ID 772889