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7-Methyl-3-phenylthiooct-6-en-4-olide
SpectraBase Compound ID JJ58J32hh3
InChI InChI=1S/C15H18O2S/c1-11(2)8-9-13-14(10-15(16)17-13)18-12-6-4-3-5-7-12/h3-8,13-14H,9-10H2,1-2H3
InChIKey QJQHBNDAXIQIOD-UHFFFAOYSA-N
Mol Weight 262.37 g/mol
Molecular Formula C15H18O2S
Exact Mass 262.102751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VOPA6x3ZIc
Name 7-Methyl-3-phenylthiooct-6-en-4-olide
CAS Registry Number 102070-50-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2S
InChI InChI=1S/C15H18O2S/c1-11(2)8-9-13-14(10-15(16)17-13)18-12-6-4-3-5-7-12/h3-8,13-14H,9-10H2,1-2H3
InChIKey QJQHBNDAXIQIOD-UHFFFAOYSA-N
Molecular Weight 262.367 g/mol
SMILES C1(OC(CC=C(C)C)C(C1)Sc1ccccc1)=O
SPLASH splash10-03di-0190000000-ce433c68e874eea72ca2
Source of Spectrum KC-1988-3372-23
Synonyms 5-(3-Methyl-2-butenyl)-4-(phenylsulfanyl)dihydro-2(3H)-furanone
Wiley ID 1265791