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2,6-bis(methylsulfanylmethyl)-6-prop-2-enyl-cyclohexa-2,4-dien-1-one
SpectraBase Compound ID 2RRiQ0cx58o
InChI InChI=1S/C13H18OS2/c1-4-7-13(10-16-3)8-5-6-11(9-15-2)12(13)14/h4-6,8H,1,7,9-10H2,2-3H3
InChIKey GNFRHWTWPKPTGK-UHFFFAOYSA-N
Mol Weight 254.41 g/mol
Molecular Formula C13H18OS2
Exact Mass 254.079908 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bN5EPhRYW
Name 2,6-bis(methylsulfanylmethyl)-6-prop-2-enyl-cyclohexa-2,4-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18OS2
InChI InChI=1S/C13H18OS2/c1-4-7-13(10-16-3)8-5-6-11(9-15-2)12(13)14/h4-6,8H,1,7,9-10H2,2-3H3
InChIKey GNFRHWTWPKPTGK-UHFFFAOYSA-N
Molecular Weight 254.406 g/mol
SMILES C1(C(=CC=CC1(CSC)CC=C)CSC)=O
SPLASH splash10-052f-2930000000-9c385a5086ef953e08bc
Source of Spectrum E1-41-443-5
Synonyms 2,6-bis[(methylthio)methyl]-6-prop-2-enyl-1-cyclohexa-2,4-dienone 6-Allyl-2,6-bis(methylsulfanylmethyl)cyclohexa-2,4-dien-1-one 6-Allyl-2,6-bis[(methylthio)methyl]cyclohexa-2,4-dien-1-one
Wiley ID 1551956