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Propanedinitrile, 2-[2-(3-ethyl-2(3H)-benzothiazolylidene)-5-oxocyclopentylidene]-
SpectraBase Compound ID FSaGRnVTISh
InChI InChI=1S/C17H13N3OS/c1-2-20-13-5-3-4-6-15(13)22-17(20)12-7-8-14(21)16(12)11(9-18)10-19/h3-6H,2,7-8H2,1H3/b17-12-
InChIKey YQXPGHMLXFZHGP-ATVHPVEESA-N
Mol Weight 307.37 g/mol
Molecular Formula C17H13N3OS
Exact Mass 307.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EFPn2y3cHo3
Name Propanedinitrile, 2-[2-(3-ethyl-2(3H)-benzothiazolylidene)-5-oxocyclopentylidene]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13N3OS
InChI InChI=1S/C17H13N3OS/c1-2-20-13-5-3-4-6-15(13)22-17(20)12-7-8-14(21)16(12)11(9-18)10-19/h3-6H,2,7-8H2,1H3/b17-12-
InChIKey YQXPGHMLXFZHGP-ATVHPVEESA-N
Molecular Weight 307.371 g/mol
SMILES CCN1\C(Sc2ccccc12)=C/1CCC(=O)C1=C(C#N)C#N
SPLASH splash10-0pb9-4393000000-fb1e9fcb22849e1a8ede
Source of Spectrum JX-2015-2-1867
Synonyms (Z)-2-(2-(3-ethylbenzo[d]thiazol-2(3H)-ylidene)-5-oxocyclopentylidene)malononitrile 2-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)-5-oxocyclopentylidene]propanedinitrile 2-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)-5-oxo-cyclopentylidene]propanedinitrile 2-[(2Z)-2-(3-ethyl-1,3-benzothiazol-2-ylidene)-5-oxidanylidene-cyclopentylidene]propanedinitrile
Wiley ID 1723483