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2,7,11-Trimethyl-4-phenylthiododeca-2,6,10-triene

View entire compound with spectra: 2 MS (GC)

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 9ZODFZXIqR
Name 2,7,11-TRIMETHYL-4-PHENYLSULFANYLDODECA-2,6,10-TRIENE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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 314.2061
SMILES CC(=CCC\C(=C\CC(C=C(C)C)Sc1ccccc1)C)C
SPLASH splash10-014l-9400000000-73ee6c4370b444c1dac6
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany