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3-(1-Aminopropylidene)-4,5-dimethyl-3H-thiophen-2-one
SpectraBase Compound ID 1IxhOT5wPy3
InChI InChI=1S/C9H13NOS/c1-4-7(10)8-5(2)6(3)12-9(8)11/h4,10H2,1-3H3/b8-7+
InChIKey GSIQWNYMACEJOC-BQYQJAHWSA-N
Mol Weight 183.27 g/mol
Molecular Formula C9H13NOS
Exact Mass 183.071785 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JBOdpUSJMAI
Name 3-(1-Aminopropylidene)-4,5-dimethyl-3H-thiophen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NOS
InChI InChI=1S/C9H13NOS/c1-4-7(10)8-5(2)6(3)12-9(8)11/h4,10H2,1-3H3/b8-7+
InChIKey GSIQWNYMACEJOC-BQYQJAHWSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(200001)342_1_75
Molecular Weight 183.269 g/mol
SMILES N\C(=C\1C(SC(=C1C)C)=O)CC
SPLASH splash10-00lr-0900000000-882c251a6bf02a1ccd2a
Source of Spectrum JF-342-78-4d
Synonyms (E)-3-(1-aminopropylidene)-4,5-dimethylthiophen-2(3H)-one
Wiley ID 1766869