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3-Thiophenecarbonitrile, 2-amino-4,5-bis[[3-(trifluoromethyl)phenyl]thio]-
SpectraBase Compound ID CkMzMTZX1tp
InChI InChI=1S/C19H10F6N2S3/c20-18(21,22)10-3-1-5-12(7-10)28-15-14(9-26)16(27)30-17(15)29-13-6-2-4-11(8-13)19(23,24)25/h1-8H,27H2
InChIKey LMDDPAOXMZBFSC-UHFFFAOYSA-N
Mol Weight 476.47 g/mol
Molecular Formula C19H10F6N2S3
Exact Mass 475.991031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HdVIZ4vF7oi
Name 3-Thiophenecarbonitrile, 2-amino-4,5-bis[[3-(trifluoromethyl)phenyl]thio]-
CAS Registry Number 130750-45-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H10F6N2S3
InChI InChI=1S/C19H10F6N2S3/c20-18(21,22)10-3-1-5-12(7-10)28-15-14(9-26)16(27)30-17(15)29-13-6-2-4-11(8-13)19(23,24)25/h1-8H,27H2
InChIKey LMDDPAOXMZBFSC-UHFFFAOYSA-N
Molecular Weight 476.473 g/mol
SMILES Nc1sc(c(c1C#N)Sc1cc(C(F)(F)F)ccc1)Sc1cc(C(F)(F)F)ccc1
SPLASH splash10-004i-0140900000-933bcd15094de792388c
Source of Spectrum H-73-802-12
Synonyms 2-Amino-4,5-bis{[3-(trifluoro-methyl)phenyl]thio}thiophene-3-carbonitrile 2-Amino-4,5-bis{[3-(trifluoromethyl)phenyl]sulfanyl}-3-thiophenecarbonitrile
Wiley ID 1394208