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5-Ethyl-3-[(E)-(3-pyridinylimino)methyl]-2-thiophenethiol
SpectraBase Compound ID 3kSsiEdfSaY
InChI InChI=1S/C12H12N2S2/c1-2-11-6-9(12(15)16-11)7-14-10-4-3-5-13-8-10/h3-8,15H,2H2,1H3/b14-7+
InChIKey BRQVEGLLRJHRPQ-VGOFMYFVSA-N
Mol Weight 248.36 g/mol
Molecular Formula C12H12N2S2
Exact Mass 248.044191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JKmvcZsLkq
Name 5-Ethyl-3-[(E)-(3-pyridinylimino)methyl]-2-thiophenethiol
Alternate Name(s) 5-Ethyl-3-(3-pyridyliminomethyl)-2-thiophenethiol
CAS Registry Number 38059-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2S2
InChI InChI=1S/C12H12N2S2/c1-2-11-6-9(12(15)16-11)7-14-10-4-3-5-13-8-10/h3-8,15H,2H2,1H3/b14-7+
InChIKey BRQVEGLLRJHRPQ-VGOFMYFVSA-N
Molecular Weight 248.362 g/mol
SMILES Sc1c(cc(s1)CC)\C=N\c1cnccc1
SPLASH splash10-0udr-9110000000-f9efb3bea5d57fbb1400
Wiley ID 1469666