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2,7,11-Trimethyl-4-phenylthiododeca-2,6,10-triene
SpectraBase Compound ID 3w62MA6C3ab
InChI InChI=1S/C21H30S/c1-17(2)10-9-11-19(5)14-15-21(16-18(3)4)22-20-12-7-6-8-13-20/h6-8,10,12-14,16,21H,9,11,15H2,1-5H3/b19-14+
InChIKey CLCACCVBCGETIN-XMHGGMMESA-N
Mol Weight 314.53 g/mol
Molecular Formula C21H30S
Exact Mass 314.206822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID zKtbDpHzcy
Name 2,7,11-Trimethyl-4-phenylthiododeca-2,6,10-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30S
InChI InChI=1S/C21H30S/c1-17(2)10-9-11-19(5)14-15-21(16-18(3)4)22-20-12-7-6-8-13-20/h6-8,10,12-14,16,21H,9,11,15H2,1-5H3/b19-14+
InChIKey CLCACCVBCGETIN-XMHGGMMESA-N
Molecular Weight 314.531 g/mol
SMILES c1cc(SC(C\C=C\(CCC=C(C)C)C)C=C(C)C)ccc1
SPLASH splash10-014l-9400000000-c10b4b05d88ed9db4d1f
Synonyms [(3E)-4,8-dimethyl-1-(2-methylprop-1-enyl)nona-3,7-dienyl]sulfanylbenzene [(6E)-2,7,11-trimethyldodeca-2,6,10-trien-4-yl]sulfanylbenzene [[(3E)-4,8-dimethyl-1-(2-methylprop-1-enyl)nona-3,7-dienyl]thio]benzene [[(6E)-2,7,11-trimethyldodeca-2,6,10-trien-4-yl]thio]benzene
Wiley ID 1485022