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2-(4-(4-Chlorophenyl)thiazol-2(3H)-ylidene)malononitrile
SpectraBase Compound ID LLgvA9GmNzr
InChI InChI=1S/C12H6ClN3S/c13-10-3-1-8(2-4-10)11-7-17-12(16-11)9(5-14)6-15/h1-4,7,16H
InChIKey VKFJCQSKQVQZSM-UHFFFAOYSA-N
Mol Weight 259.71 g/mol
Molecular Formula C12H6ClN3S
Exact Mass 258.997096 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKEHobE6IVO
Name 2-(4-(4-Chlorophenyl)thiazol-2(3H)-ylidene)malononitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H6ClN3S
InChI InChI=1S/C12H6ClN3S/c13-10-3-1-8(2-4-10)11-7-17-12(16-11)9(5-14)6-15/h1-4,7,16H
InChIKey VKFJCQSKQVQZSM-UHFFFAOYSA-N
Instrument Name VG Autospec Q MS 30
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0011.217
Molecular Weight 259.714 g/mol
SMILES N1C(SC=C1c1ccc(Cl)cc1)=C(C#N)C#N
SPLASH splash10-0bt9-1290000000-b18f37929dff369baf40
Source of Spectrum ARK-2010-229-7b
Wiley ID 1866868