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(3Z)-6,7-dimethyl-3-(p-tolylsulfonylmethylene)oct-6-en-2-one
SpectraBase Compound ID H0ZkdKG5wEX
InChI InChI=1S/C18H24O3S/c1-13(2)15(4)8-9-17(16(5)19)12-22(20,21)18-10-6-14(3)7-11-18/h6-7,10-12H,8-9H2,1-5H3/b17-12-
InChIKey HCWPIHJYYWFCPC-ATVHPVEESA-N
Mol Weight 320.45 g/mol
Molecular Formula C18H24O3S
Exact Mass 320.144616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ej6VukX76q
Name (3Z)-6,7-dimethyl-3-(p-tolylsulfonylmethylene)oct-6-en-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O3S
InChI InChI=1S/C18H24O3S/c1-13(2)15(4)8-9-17(16(5)19)12-22(20,21)18-10-6-14(3)7-11-18/h6-7,10-12H,8-9H2,1-5H3/b17-12-
InChIKey HCWPIHJYYWFCPC-ATVHPVEESA-N
Molecular Weight 320.447 g/mol
SMILES C(\C(=C/S(c1ccc(cc1)C)(=O)=O)CCC(=C(C)C)C)(=O)C
SPLASH splash10-000x-9100000000-50eed4873e72f3bfbb17
Source of Spectrum J-63-7916-8
Synonyms (3Z)-6,7-dimethyl-3-(tosylmethylene)oct-6-en-2-one (3Z)-6,7-dimethyl-3-[(4-methylphenyl)sulfonylmethylidene]-6-octen-2-one (3Z)-6,7-dimethyl-3-[(4-methylphenyl)sulfonylmethylidene]oct-6-en-2-one
Wiley ID 1320120