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Ethyl 2-methylthio-4-(6'-methoxy-1'-naphthyl)-butyrate
SpectraBase Compound ID 2Ly7qwuxVWE
InChI InChI=1S/C18H22O3S/c1-4-21-18(19)17(22-3)11-8-13-6-5-7-14-12-15(20-2)9-10-16(13)14/h5-7,9-10,12,17H,4,8,11H2,1-3H3
InChIKey QCDHOWAMIMIXKR-UHFFFAOYSA-N
Mol Weight 318.43 g/mol
Molecular Formula C18H22O3S
Exact Mass 318.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DgqfNPEF2M6
Name Ethyl 2-methylthio-4-(6'-methoxy-1'-naphthyl)-butyrate
Alternate Name(s) Ethyl 4-(6-methoxy-1-naphthyl)-2-(methylsulfanyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O3S
InChI InChI=1S/C18H22O3S/c1-4-21-18(19)17(22-3)11-8-13-6-5-7-14-12-15(20-2)9-10-16(13)14/h5-7,9-10,12,17H,4,8,11H2,1-3H3
InChIKey QCDHOWAMIMIXKR-UHFFFAOYSA-N
Molecular Weight 318.431 g/mol
SMILES c12c(cc(cc2)OC)cccc1CCC(C(=O)OCC)SC
SPLASH splash10-00di-0930000000-14336b1be2478a4e6b7d
Source of Spectrum C-98-4897-0
Wiley ID 1318487