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5-Chloro-4-[N-(cyanomethyl)-N-isopropylamino]-4,5-didehydro-1,2-dithiol-3-one
SpectraBase Compound ID Fsk24V1sFuz
InChI InChI=1S/C8H9ClN2OS2/c1-5(2)11(4-3-10)6-7(9)13-14-8(6)12/h5H,4H2,1-2H3
InChIKey LPZFAOPLZHAJNS-UHFFFAOYSA-N
Mol Weight 248.75 g/mol
Molecular Formula C8H9ClN2OS2
Exact Mass 247.984483 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43TeEcZuZf9
Name 5-Chloro-4-[N-(cyanomethyl)-N-isopropylamino]-4,5-didehydro-1,2-dithiol-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H9ClN2OS2
InChI InChI=1S/C8H9ClN2OS2/c1-5(2)11(4-3-10)6-7(9)13-14-8(6)12/h5H,4H2,1-2H3
InChIKey LPZFAOPLZHAJNS-UHFFFAOYSA-N
Molecular Weight 248.746 g/mol
SMILES C1(=C(SSC1=O)Cl)N(C(C)C)CC#N
SPLASH splash10-0532-0190000000-beb4af9befa0515e706d
Source of Spectrum MN-2001-167-13
Synonyms N-[3'-Oxo-5'-chloro-1',2'-dithiol-4'-yl]-N-isopropyl-N-(cyanomethyl)amine [(5-chloro-3-oxo-3H-1,2-dithiol-4-yl)(isopropyl)amino]acetonitrile
Wiley ID 1546482