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(E) and (Z)-(6R,7S)-6,8-Dimethyl-5,7,8-tris(phenylthio)non-2-ene
SpectraBase Compound ID 4tSsEGaqytZ
InChI InChI=1S/C29H34S3/c1-5-6-22-27(30-24-16-10-7-11-17-24)23(2)28(31-25-18-12-8-13-19-25)29(3,4)32-26-20-14-9-15-21-26/h5-21,23,27-28H,22H2,1-4H3/b6-5+
InChIKey JTRGWNSRUKIELY-AATRIKPKSA-N
Mol Weight 478.8 g/mol
Molecular Formula C29H34S3
Exact Mass 478.182265 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 483FD4Zj4sb
Name (E) and (Z)-(6R,7S)-6,8-Dimethyl-5,7,8-tris(phenylthio)non-2-ene
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Formula C29H34S3
InChI InChI=1S/C29H34S3/c1-5-6-22-27(30-24-16-10-7-11-17-24)23(2)28(31-25-18-12-8-13-19-25)29(3,4)32-26-20-14-9-15-21-26/h5-21,23,27-28H,22H2,1-4H3/b6-5+
InChIKey JTRGWNSRUKIELY-AATRIKPKSA-N
Molecular Weight 478.771 g/mol
SMILES C(C(Sc1ccccc1)(C)C)(C(C(Sc1ccccc1)C\C=C\C)C)Sc1ccccc1
SPLASH splash10-0pvi-0935000000-6bbd7f783a26716a1f7a
Source of Spectrum KC-0-2961-17
Synonyms (E) and (Z)-(6RS,7RS)-6,8-Dimethyl-5,7,8-tris(phenylthio)non-2-ene (E)-(6RS,7RS)-6,8-Dimethyl-5,7,8-tris(phenylthio)non-2-ene {[(2S,3R,6E)-1,1,3-trimethyl-2,4-bis(phenylsulfanyl)-6-octenyl]sulfanyl}benzene
Wiley ID 782382