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2,6-bis(Phenylthio)bicyclo[3.3.1]nona-2,6-diene
SpectraBase Compound ID Cq9hhD55K0A
InChI InChI=1S/C21H20S2/c1-3-7-18(8-4-1)22-20-13-11-17-15-16(20)12-14-21(17)23-19-9-5-2-6-10-19/h1-10,13-14,16-17H,11-12,15H2
InChIKey VXGHIBYBRJBJDC-UHFFFAOYSA-N
Mol Weight 336.51 g/mol
Molecular Formula C21H20S2
Exact Mass 336.100643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4umIeT5QOuZ
Name 2,6-bis(Phenylthio)bicyclo[3.3.1]nona-2,6-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20S2
InChI InChI=1S/C21H20S2/c1-3-7-18(8-4-1)22-20-13-11-17-15-16(20)12-14-21(17)23-19-9-5-2-6-10-19/h1-10,13-14,16-17H,11-12,15H2
InChIKey VXGHIBYBRJBJDC-UHFFFAOYSA-N
Molecular Weight 336.511 g/mol
SMILES C12C(=CCC(C(=CC2)Sc2ccccc2)C1)Sc1ccccc1
SPLASH splash10-00n0-0947000000-155fbff84a2ac0688218
Source of Spectrum U-1996-994-9
Synonyms 2,6-bis(phenylsulfanyl)bicyclo[3.3.1]nona-2,6-diene
Wiley ID 768547