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3,4-Bis(benzylthio)cyclobutenedione
SpectraBase Compound ID 7TjyqFeMuqy
InChI InChI=1S/C18H14O2S2/c19-15-16(20)18(22-12-14-9-5-2-6-10-14)17(15)21-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey NXASECFPEMNQPX-UHFFFAOYSA-N
Mol Weight 326.43 g/mol
Molecular Formula C18H14O2S2
Exact Mass 326.043522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GV1PjyrgXBf
Name 3,4-Bis(benzylthio)cyclobutenedione
Alternate Name(s) 3,4-bis(benzylsulfanyl)-3-cyclobutene-1,2-dione
CAS Registry Number 52427-63-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14O2S2
InChI InChI=1S/C18H14O2S2/c19-15-16(20)18(22-12-14-9-5-2-6-10-14)17(15)21-11-13-7-3-1-4-8-13/h1-10H,11-12H2
InChIKey NXASECFPEMNQPX-UHFFFAOYSA-N
Molecular Weight 326.428 g/mol
SMILES C1(=C(SCc2ccccc2)C(C1=O)=O)SCc1ccccc1
SPLASH splash10-0006-9211000000-f90dc8069c86c6e32489
Source of Spectrum J-41-3907-0
Wiley ID 1324697