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N-[(E)-3-Methyl-buta-1,3-dienyl]pyrrolidine-2-thione
SpectraBase Compound ID 3ROxvjBJnB2
InChI InChI=1S/C9H13NS/c1-8(2)5-7-10-6-3-4-9(10)11/h5,7H,1,3-4,6H2,2H3/b7-5+
InChIKey SVSLOYFYNXGTJK-FNORWQNLSA-N
Mol Weight 167.27 g/mol
Molecular Formula C9H13NS
Exact Mass 167.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QZLIqBGijs
Name N-[(E)-3-Methyl-buta-1,3-dienyl]pyrrolidine-2-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NS
InChI InChI=1S/C9H13NS/c1-8(2)5-7-10-6-3-4-9(10)11/h5,7H,1,3-4,6H2,2H3/b7-5+
InChIKey SVSLOYFYNXGTJK-FNORWQNLSA-N
Literature Reference DOI 10.1021/ol801736h
Molecular Weight 167.270 g/mol
SMILES C1CN(\C=C\C(C)=C)C(=S)C1
SPLASH splash10-003r-0900000000-0d6cfd526dc5f1b8c33c
Source of Spectrum A1-10-4497/SMS5-3i
Synonyms (E)-1-(3-methylbuta-1,3-dien-1-yl)pyrrolidine-2-thione
Wiley ID 1759906