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2,12-Bisbenzylsulfanyl-7-oxa-[5]-helicene

View entire compound with spectra: 1 MS (GC)

2,12-Bisbenzylsulfanyl-7-oxa-[5]-helicene
SpectraBase Compound ID 535K6sJ4mg6
InChI InChI=1S/C34H24OS2/c1-3-7-23(8-4-1)21-36-27-15-11-25-13-17-31-33(29(25)19-27)34-30-20-28(37-22-24-9-5-2-6-10-24)16-12-26(30)14-18-32(34)35-31/h1-20H,21-22H2
InChIKey NEFLFRXAHADCLN-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C34H24OS2
Exact Mass 512.126858 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3iv4NfZCNc
Name 2,12-Bisbenzylsulfanyl-7-oxa-[5]-helicene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H24OS2
InChI InChI=1S/C34H24OS2/c1-3-7-23(8-4-1)21-36-27-15-11-25-13-17-31-33(29(25)19-27)34-30-20-28(37-22-24-9-5-2-6-10-24)16-12-26(30)14-18-32(34)35-31/h1-20H,21-22H2
InChIKey NEFLFRXAHADCLN-UHFFFAOYSA-N
Molecular Weight 512.685 g/mol
SMILES c12c3c(ccc4c3cc(SCc3ccccc3)cc4)oc2ccc2c1cc(SCc1ccccc1)cc2
SPLASH splash10-03k9-0003490000-69dcfdb79b13e1e93a0b
Source of Spectrum Y1-45-3070-1
Wiley ID 1622069