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(Z,Z)-1,4-Di(benzylthio)-1,4-di(p-tert-butylphenyl)-1,3-butadiene
SpectraBase Compound ID FKVrtZkSWjQ
InChI InChI=1S/C38H42S2/c1-37(2,3)33-21-17-31(18-22-33)35(39-27-29-13-9-7-10-14-29)25-26-36(40-28-30-15-11-8-12-16-30)32-19-23-34(24-20-32)38(4,5)6/h7-26H,27-28H2,1-6H3/b35-25-,36-26-
InChIKey SWUXMOMUGFLCBZ-SDURLSCFSA-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 3SlM8LuNtbZ
Name (Z,Z)-1,4-Di(benzylthio)-1,4-di(p-tert-butylphenyl)-1,3-butadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H42S2
InChI InChI=1S/C38H42S2/c1-37(2,3)33-21-17-31(18-22-33)35(39-27-29-13-9-7-10-14-29)25-26-36(40-28-30-15-11-8-12-16-30)32-19-23-34(24-20-32)38(4,5)6/h7-26H,27-28H2,1-6H3/b35-25-,36-26-
InChIKey SWUXMOMUGFLCBZ-SDURLSCFSA-N
Molecular Weight 562.874 g/mol
SMILES C(S\C(=C/C=C/(SCc1ccccc1)c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)c1ccccc1
SPLASH splash10-006t-0009410000-20b1d9da33c1838d36cc
Source of Spectrum F-52-12687-4
Synonyms 1-[(1Z,3Z)-1,4-bis(benzylsulfanyl)-4-(4-tert-butylphenyl)-1,3-butadienyl]-4-tert-butylbenzene
Wiley ID 799136