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2-(1-naphthyl)-2-(o-tolylthio)pent-4-enoic acid methyl ester
SpectraBase Compound ID 7yEwTojzAzh
InChI InChI=1S/C23H22O2S/c1-4-16-23(22(24)25-3,26-21-15-8-5-10-17(21)2)20-14-9-12-18-11-6-7-13-19(18)20/h4-15H,1,16H2,2-3H3
InChIKey GMULDYFIZUHCDT-UHFFFAOYSA-N
Mol Weight 362.49 g/mol
Molecular Formula C23H22O2S
Exact Mass 362.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LUvcwt479tP
Name 2-(1-naphthyl)-2-(o-tolylthio)pent-4-enoic acid methyl ester
Alternate Name(s) 2-[(2-methylphenyl)thio]-2-(1-naphthalenyl)-4-pentenoic acid methyl ester Methyl 2-(1-naphthyl)-2-(o-tolylsulfanyl)pent-4-enoate Methyl 2-(2-methylphenyl)sulfanyl-2-naphthalen-1-yl-pent-4-enoate
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Formula C23H22O2S
InChI InChI=1S/C23H22O2S/c1-4-16-23(22(24)25-3,26-21-15-8-5-10-17(21)2)20-14-9-12-18-11-6-7-13-19(18)20/h4-15H,1,16H2,2-3H3
InChIKey GMULDYFIZUHCDT-UHFFFAOYSA-N
Molecular Weight 362.487 g/mol
SMILES C(Sc1c(C)cccc1)(c1c2c(cccc2)ccc1)(C(=O)OC)CC=C
SPLASH splash10-004r-3951000000-ee0cded93f84c53c876c
Source of Spectrum J-67-5624-3
Wiley ID 1570607