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Methylsilaphane [Tribenzo-7-sila-7-methyl-3,11,21-trithia[14]metacyclophane]
SpectraBase Compound ID Ck09RRiJomY
InChI InChI=1S/C34H36S3Si/c1-38-32-11-5-2-8-29(32)23-35-17-14-26-20-27(15-18-36-24-30-9-3-6-12-33(30)38)22-28(21-26)16-19-37-25-31-10-4-7-13-34(31)38/h2-13,20-22H,14-19,23-25H2,1H3
InChIKey PMPNOUOPGVPSNM-UHFFFAOYSA-N
Mol Weight 568.9 g/mol
Molecular Formula C34H36S3Si
Exact Mass 568.174841 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1pAYgZkv0n6
Name Methylsilaphane [Tribenzo-7-sila-7-methyl-3,11,21-trithia[14]metacyclophane]
Comments Less than 3 mono-isotopic peaks
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Formula C34H36S3Si
InChI InChI=1S/C34H36S3Si/c1-38-32-11-5-2-8-29(32)23-35-17-14-26-20-27(15-18-36-24-30-9-3-6-12-33(30)38)22-28(21-26)16-19-37-25-31-10-4-7-13-34(31)38/h2-13,20-22H,14-19,23-25H2,1H3
InChIKey PMPNOUOPGVPSNM-UHFFFAOYSA-N
Molecular Weight 568.927 g/mol
SMILES c12[Si]3(c4c(CSCCc5cc(CCSCc2cccc1)cc(c5)CCSCc1c3cccc1)cccc4)C
SPLASH splash10-0002-0900030000-fb136eb21123c16ec67d
Source of Spectrum J-64-5632-15
Wiley ID 1530722