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9H-4,8-Metheno-3H-2,10-benzodithiacyclotridecin, 1,11-dihydro-16-[1,1'-biphenyl]-3-yl-
SpectraBase Compound ID 8cbAI2SLidp
InChI InChI=1S/C28H24S2/c1-2-8-21(9-3-1)22-12-6-13-23(16-22)28-26-14-7-15-27(28)20-30-18-25-11-5-4-10-24(25)17-29-19-26/h1-16H,17-20H2
InChIKey SJYYEPQSQPGQMI-UHFFFAOYSA-N
Mol Weight 424.62 g/mol
Molecular Formula C28H24S2
Exact Mass 424.131943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8iMnqto9HWT
Name 9H-4,8-Metheno-3H-2,10-benzodithiacyclotridecin, 1,11-dihydro-16-[1,1'-biphenyl]-3-yl-
CAS Registry Number 124537-08-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24S2
InChI InChI=1S/C28H24S2/c1-2-8-21(9-3-1)22-12-6-13-23(16-22)28-26-14-7-15-27(28)20-30-18-25-11-5-4-10-24(25)17-29-19-26/h1-16H,17-20H2
InChIKey SJYYEPQSQPGQMI-UHFFFAOYSA-N
Molecular Weight 424.620 g/mol
SMILES c1(-c2c3CSCc4ccccc4CSCc2ccc3)cc(-c2ccccc2)ccc1
SPLASH splash10-000i-0930000000-70ea97c3bdce1d65baba
Source of Spectrum J-55-889-25
Synonyms 18-[1,1'-biphenyl]-3-yl-3,12-dithiatricyclo[12.3.1.0(5,10)]octadeca-1(18),5,7,9,14,16-hexaene 9-(3-Biphenylyl)-2H,5H,7H,11H-dibenzo[c,h][1,6]dithiacycloundecin
Wiley ID 1379450