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Naphthalene, 1-[[(4-chlorophenyl)thio]methyl]-8-[[(4-methylphenyl)thio]methyl]-
SpectraBase Compound ID 3z3IJ4xy4pR
InChI InChI=1S/C25H21ClS2/c1-18-8-12-23(13-9-18)27-16-20-6-2-4-19-5-3-7-21(25(19)20)17-28-24-14-10-22(26)11-15-24/h2-15H,16-17H2,1H3
InChIKey XHTLEKWOEVXDOA-UHFFFAOYSA-N
Mol Weight 421.02 g/mol
Molecular Formula C25H21ClS2
Exact Mass 420.077321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LSd0Nq5dl91
Name Naphthalene, 1-[[(4-chlorophenyl)thio]methyl]-8-[[(4-methylphenyl)thio]methyl]-
CAS Registry Number 97840-95-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H21ClS2
InChI InChI=1S/C25H21ClS2/c1-18-8-12-23(13-9-18)27-16-20-6-2-4-19-5-3-7-21(25(19)20)17-28-24-14-10-22(26)11-15-24/h2-15H,16-17H2,1H3
InChIKey XHTLEKWOEVXDOA-UHFFFAOYSA-N
Molecular Weight 421.016 g/mol
SMILES c12c(CSc3ccc(cc3)Cl)cccc1cccc2CSc1ccc(cc1)C
SPLASH splash10-0ufs-0970000000-17f9c99f2255ebd5f70e
Source of Spectrum O-20-230-5
Synonyms 1-(para-tolyl)thiomethyl-8-(4'-chlorophenyl)thiomethylnaphtalene 1-{[(4-chlorophenyl)sulfanyl]methyl}-8-{[(4-methylphenyl)sulfanyl]methyl}naphthalene
Wiley ID 1378049