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Propanedinitrile, 2-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-
SpectraBase Compound ID 4M2dedsyN4X
InChI InChI=1S/C16H14ClN3O/c1-2-3-8-20-14-9-13(17)5-6-15(14)21-16(20)7-4-12(10-18)11-19/h4-7,9H,2-3,8H2,1H3/b16-7-
InChIKey WLJKDHVRCKAJDR-APSNUPSMSA-N
Mol Weight 299.76 g/mol
Molecular Formula C16H14ClN3O
Exact Mass 299.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfVfh68LsCB
Name Propanedinitrile, 2-[2-(3-butyl-5-chloro-2(3H)-benzoxazolylidene)ethylidene]-
Alternate Name(s) (Z)-2-(2-(3-butyl-5-chlorobenzo[d]oxazol-2(3H)-ylidene)ethylidene)malononitrile 2-[(2Z)-2-(3-butyl-5-chloro-1,3-benzoxazol-2-ylidene)ethylidene]propanedinitrile 2-[(2Z)-2-(3-butyl-5-chloranyl-1,3-benzoxazol-2-ylidene)ethylidene]propanedinitrile
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Formula C16H14ClN3O
InChI InChI=1S/C16H14ClN3O/c1-2-3-8-20-14-9-13(17)5-6-15(14)21-16(20)7-4-12(10-18)11-19/h4-7,9H,2-3,8H2,1H3/b16-7-
InChIKey WLJKDHVRCKAJDR-APSNUPSMSA-N
Molecular Weight 299.761 g/mol
SMILES CCCCN1\C(Oc2ccc(Cl)cc12)=C\C=C(C#N)C#N
SPLASH splash10-052e-3291000000-8a585aba163aa98925c0
Source of Spectrum JX-2015-2-1612
Wiley ID 1723244