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3-Methyl-5-phenylthioundeca-1,4(Z)-diene
SpectraBase Compound ID F7AIrSTsIiX
InChI InChI=1S/C18H26S/c1-4-6-7-9-14-18(15-16(3)5-2)19-17-12-10-8-11-13-17/h5,8,10-13,15-16H,2,4,6-7,9,14H2,1,3H3/b18-15-
InChIKey LFAMCWFNYNYTEQ-SDXDJHTJSA-N
Mol Weight 274.47 g/mol
Molecular Formula C18H26S
Exact Mass 274.175522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7adJyTJV7uA
Name 3-Methyl-5-phenylthioundeca-1,4(Z)-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26S
InChI InChI=1S/C18H26S/c1-4-6-7-9-14-18(15-16(3)5-2)19-17-12-10-8-11-13-17/h5,8,10-13,15-16H,2,4,6-7,9,14H2,1,3H3/b18-15-
InChIKey LFAMCWFNYNYTEQ-SDXDJHTJSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 274.466 g/mol
SMILES C(\C=C\(Sc1ccccc1)CCCCCC)(C=C)C
SPLASH splash10-0002-9700000000-8599899a09e1502c0fcc
Source of Spectrum A1-9-263/SMS9-5
Synonyms (Z)-(3-methylundeca-1,4-dien-5-yl)(phenyl)sulfane
Wiley ID 1757778