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Butanenitrile, 2,2'-(1,2,4-trithiolane-3,5-diylidene)bis[3,3-dimethyl-, (E,Z)-
SpectraBase Compound ID GPIItWhzhWZ
InChI InChI=1S/C14H18N2S3/c1-13(2,3)9(7-15)11-17-12(19-18-11)10(8-16)14(4,5)6/h1-6H3/b11-9-,12-10+
InChIKey DQADRRJXAXYBBI-DSOJMZEYSA-N
Mol Weight 310.49 g/mol
Molecular Formula C14H18N2S3
Exact Mass 310.063212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9iyQarql0fE
Name Butanenitrile, 2,2'-(1,2,4-trithiolane-3,5-diylidene)bis[3,3-dimethyl-, (E,Z)-
CAS Registry Number 91529-55-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18N2S3
InChI InChI=1S/C14H18N2S3/c1-13(2,3)9(7-15)11-17-12(19-18-11)10(8-16)14(4,5)6/h1-6H3/b11-9-,12-10+
InChIKey DQADRRJXAXYBBI-DSOJMZEYSA-N
Molecular Weight 310.492 g/mol
SMILES C(\C(=C\1S\C(SS1)=C/(C#N)C(C)(C)C)C(C)(C)C)#N
SPLASH splash10-0a4i-9100000000-7e51868fb45c0406125d
Source of Spectrum K-117-2215-0
Synonyms (2Z)-2-[(5E)-5-(1-cyano-2,2-dimethylpropylidene)-1,2,4-trithiolan-3-ylidene]-3,3-dimethylbutanenitrile 1,2,4-Trithiolane, butanenitrile deriv. trans-2,2'-(1,2,4-trithiolan-3,5-diylidene)-bis(3,3-dimethylbutyronitrile)
Wiley ID 1311203