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6-Methyl-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate
SpectraBase Compound ID 7ESi2VN7qBl
InChI InChI=1S/C22H26O2S/c1-16(2)10-15-21(25-20-13-11-17(3)12-14-20)18(4)24-22(23)19-8-6-5-7-9-19/h5-14,18,21H,15H2,1-4H3
InChIKey SNIAWRPGYYJWFE-UHFFFAOYSA-N
Mol Weight 354.51 g/mol
Molecular Formula C22H26O2S
Exact Mass 354.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 98GeHBwvBJs
Name 6-Methyl-3-[(4'-methylphenyl)sulfenyl]hept-5-en-2-yl benzoate
Alternate Name(s) 1,5-Dimethyl-2-[(4-methylphenyl)sulfanyl]-4-hexenyl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26O2S
InChI InChI=1S/C22H26O2S/c1-16(2)10-15-21(25-20-13-11-17(3)12-14-20)18(4)24-22(23)19-8-6-5-7-9-19/h5-14,18,21H,15H2,1-4H3
InChIKey SNIAWRPGYYJWFE-UHFFFAOYSA-N
Molecular Weight 354.508 g/mol
SMILES C(OC(C(Sc1ccc(cc1)C)CC=C(C)C)C)(=O)c1ccccc1
SPLASH splash10-0a4i-1910000000-6b200240ccab18e6c61a
Source of Spectrum U1-1999-122-8
Wiley ID 752256