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4-Methyl-2-(phenylsulfanyl)-6-propylbenzoic acid methyl ester
SpectraBase Compound ID 8b8b4xtvkbO
InChI InChI=1S/C18H20O2S/c1-4-8-14-11-13(2)12-16(17(14)18(19)20-3)21-15-9-6-5-7-10-15/h5-7,9-12H,4,8H2,1-3H3
InChIKey AKDYJCLHECHSHB-UHFFFAOYSA-N
Mol Weight 300.42 g/mol
Molecular Formula C18H20O2S
Exact Mass 300.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FtN3ZFgoaWz
Name 4-Methyl-2-(phenylsulfanyl)-6-propylbenzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O2S
InChI InChI=1S/C18H20O2S/c1-4-8-14-11-13(2)12-16(17(14)18(19)20-3)21-15-9-6-5-7-10-15/h5-7,9-12H,4,8H2,1-3H3
InChIKey AKDYJCLHECHSHB-UHFFFAOYSA-N
Molecular Weight 300.416 g/mol
SMILES c1(c(Sc2ccccc2)cc(C)cc1CCC)C(=O)OC
SPLASH splash10-0f79-0595000000-50b944bcead1560d36f6
Source of Spectrum F-65-7565-5e
Wiley ID 1680394