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Carbamothioic acid, dimethyl-, S-[2-cyano-1-[(2-cyano-3,3-dimethyl-1-butenyl)dithio]-3,3-dimethyl-1- butenyl]ester
SpectraBase Compound ID IWzLPaO6zKG
InChI InChI=1S/C17H25N3OS3/c1-16(2,3)12(9-18)11-22-24-14(23-15(21)20(7)8)13(10-19)17(4,5)6/h11H,1-8H3/b12-11+,14-13-
InChIKey GPNDCAVBSVDEBK-WCYNZMGESA-N
Mol Weight 383.59 g/mol
Molecular Formula C17H25N3OS3
Exact Mass 383.115976 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4j3ePk74zkE
Name Carbamothioic acid, dimethyl-, S-[2-cyano-1-[(2-cyano-3,3-dimethyl-1-butenyl)dithio]-3,3-dimethyl-1- butenyl]ester
CAS Registry Number 91529-58-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H25N3OS3
InChI InChI=1S/C17H25N3OS3/c1-16(2,3)12(9-18)11-22-24-14(23-15(21)20(7)8)13(10-19)17(4,5)6/h11H,1-8H3/b12-11+,14-13-
InChIKey GPNDCAVBSVDEBK-WCYNZMGESA-N
Molecular Weight 383.587 g/mol
SMILES C(S\C(=C/(C#N)C(C)(C)C)SS\C=C/(C#N)C(C)(C)C)(N(C)C)=O
SPLASH splash10-00di-9101000000-2aeefaa6a189e8495377
Source of Spectrum K-117-2219-0
Synonyms S-((1E)-2-cyano-1-{[(1Z)-2-cyano-3,3-dimethyl-1-butenyl]disulfanyl}-3,3-dimethyl-1-butenyl) dimethylthiocarbamate S-[5-cyano-1-(1-cyano-2,2-dimethylpropylidene)-6,6-dimethyl-2,3-dithia-4-heptenyl]ester of dimethylthiocarbamidic acid
Wiley ID 1360998