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N-(2,2-Dicyano-1-thioxoethyl)-N-(phenylsulfonyl)pentanethioamide
SpectraBase Compound ID AH6I8lq8Scg
InChI InChI=1S/C15H15N3O2S3/c1-2-3-9-14(21)18(15(22)12(10-16)11-17)23(19,20)13-7-5-4-6-8-13/h4-8,12H,2-3,9H2,1H3
InChIKey GUUCFDYMGFZLCL-UHFFFAOYSA-N
Mol Weight 365.48 g/mol
Molecular Formula C15H15N3O2S3
Exact Mass 365.03264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JuBJsRTiSV1
Name N-(2,2-Dicyano-1-thioxoethyl)-N-(phenylsulfonyl)pentanethioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H15N3O2S3
InChI InChI=1S/C15H15N3O2S3/c1-2-3-9-14(21)18(15(22)12(10-16)11-17)23(19,20)13-7-5-4-6-8-13/h4-8,12H,2-3,9H2,1H3
InChIKey GUUCFDYMGFZLCL-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200600
Molecular Weight 365.484 g/mol
SMILES C(N(S(=O)(=O)c1ccccc1)C(=S)CCCC)(C(C#N)C#N)=S
SPLASH splash10-052f-8900000000-f735ac6d0443594f5d33
Source of Spectrum H-96-2145-11b
Synonyms N-(2,2-dicyanoethanethioyl)-N-(phenylsulfonyl)pentanethioamide
Wiley ID 1784598