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2-[(tosylamino)imino]-4,5-bis(trifluoromethyl)-1,3-dithiacyclopent-4-ene
SpectraBase Compound ID D2ACaGoaeXa
InChI InChI=1S/C12H8F6N2O2S3/c1-6-2-4-7(5-3-6)25(21,22)20-19-10-23-8(11(13,14)15)9(24-10)12(16,17)18/h2-5,20H,1H3
InChIKey FZDUYWCOAGJWGI-UHFFFAOYSA-N
Mol Weight 422.38 g/mol
Molecular Formula C12H8F6N2O2S3
Exact Mass 421.96521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LQnBOlMiyE
Name 2-[(tosylamino)imino]-4,5-bis(trifluoromethyl)-1,3-dithiacyclopent-4-ene
Alternate Name(s) N'-[4,5-bis(trifluoromethyl)-1,3-dithiol-2-ylidene]-4-methylbenzenesulfonohydrazide
CAS Registry Number 133816-28-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8F6N2O2S3
InChI InChI=1S/C12H8F6N2O2S3/c1-6-2-4-7(5-3-6)25(21,22)20-19-10-23-8(11(13,14)15)9(24-10)12(16,17)18/h2-5,20H,1H3
InChIKey FZDUYWCOAGJWGI-UHFFFAOYSA-N
Molecular Weight 422.378 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)N=C1SC(=C(S1)C(F)(F)F)C(F)(F)F
SPLASH splash10-0006-9000000000-23aea8d80fb9af38da00
Source of Spectrum K-124-2030-12
Wiley ID 1378418