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(E)-2,4-Diaminoperfluoro-4-methyl-2-pentenethio-cyanate-3
SpectraBase Compound ID DkNXGo4HifU
InChI InChI=1S/C7H4F9N3S/c8-5(9,10)2(18)3(20-1-17)4(19,6(11,12)13)7(14,15)16/h18-19H2/b3-2+
InChIKey TZHYLYSWMUCIOA-NSCUHMNNSA-N
Mol Weight 333.18 g/mol
Molecular Formula C7H4F9N3S
Exact Mass 332.998222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6E5mUzurlGY
Name (E)-2,4-Diaminoperfluoro-4-methyl-2-pentenethio-cyanate-3
Alternate Name(s) (E)-1,1,1,5,5,5-hexafluoro-3-thiocyanato-4-(trifluoromethyl)pent-2-ene-2,4-diamine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4F9N3S
InChI InChI=1S/C7H4F9N3S/c8-5(9,10)2(18)3(20-1-17)4(19,6(11,12)13)7(14,15)16/h18-19H2/b3-2+
InChIKey TZHYLYSWMUCIOA-NSCUHMNNSA-N
Literature Reference DOI 10.1002/hc.520030205
Molecular Weight 333.176 g/mol
SMILES NC(\C(=C/(N)C(F)(F)F)SC#N)(C(F)(F)F)C(F)(F)F
SPLASH splash10-03yl-1193000000-fd9a3bba4600a206b9d6
Source of Spectrum HAC-3-111-4
Wiley ID 1799418