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(Z,Z)-1,4-Di(benzylthio)-1,4-di(p-butylphenyl)-1,3-butadiene
SpectraBase Compound ID 1ocEdM7nbQL
InChI InChI=1S/C38H42S2/c1-3-5-13-31-19-23-35(24-20-31)37(39-29-33-15-9-7-10-16-33)27-28-38(40-30-34-17-11-8-12-18-34)36-25-21-32(22-26-36)14-6-4-2/h7-12,15-28H,3-6,13-14,29-30H2,1-2H3/b37-27-,38-28-
InChIKey GLWZFZOQXKDOID-KJLMGFARSA-N
Mol Weight 562.9 g/mol
Molecular Formula C38H42S2
Exact Mass 562.272794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2OuZuQqvrIu
Name (Z,Z)-1,4-Di(benzylthio)-1,4-di(p-butylphenyl)-1,3-butadiene
Alternate Name(s) 1-[(1Z,3Z)-1,4-bis(benzylsulfanyl)-4-(4-butylphenyl)-1,3-butadienyl]-4-butylbenzene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42S2
InChI InChI=1S/C38H42S2/c1-3-5-13-31-19-23-35(24-20-31)37(39-29-33-15-9-7-10-16-33)27-28-38(40-30-34-17-11-8-12-18-34)36-25-21-32(22-26-36)14-6-4-2/h7-12,15-28H,3-6,13-14,29-30H2,1-2H3/b37-27-,38-28-
InChIKey GLWZFZOQXKDOID-KJLMGFARSA-N
Molecular Weight 562.874 g/mol
SMILES C(S\C(=C/C=C/(SCc1ccccc1)c1ccc(cc1)CCCC)c1ccc(cc1)CCCC)c1ccccc1
SPLASH splash10-006t-0009410000-1b5d8c349accbb472032
Source of Spectrum F-52-12687-4
Wiley ID 799137