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6-Hydroxy-6-methyl-5-phenylthiohepta-1,4(Z)-diene
SpectraBase Compound ID HnqTugBjELD
InChI InChI=1S/C14H18OS/c1-4-5-11-13(14(2,3)15)16-12-9-7-6-8-10-12/h4,6-11,15H,1,5H2,2-3H3/b13-11-
InChIKey ZYCVQRGDULLTLB-QBFSEMIESA-N
Mol Weight 234.36 g/mol
Molecular Formula C14H18OS
Exact Mass 234.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dz9obFLSkN3
Name 6-Hydroxy-6-methyl-5-phenylthiohepta-1,4(Z)-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18OS
InChI InChI=1S/C14H18OS/c1-4-5-11-13(14(2,3)15)16-12-9-7-6-8-10-12/h4,6-11,15H,1,5H2,2-3H3/b13-11-
InChIKey ZYCVQRGDULLTLB-QBFSEMIESA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 234.357 g/mol
SMILES OC(\C(Sc1ccccc1)=C\CC=C)(C)C
SPLASH splash10-0pbc-7490000000-31b87abbbe33ed5f72be
Source of Spectrum A1-9-263/SMS4-3ga
Synonyms (Z)-2-methyl-3-(phenylthio)hepta-3,6-dien-2-ol
Wiley ID 1757753