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(R*)-Ethyl benzoyloxy-[( 4-methylphenyl)sulfanyl]acetate
SpectraBase Compound ID 1NoaNR8qmi6
InChI InChI=1S/C18H18O4S/c1-3-21-17(20)18(23-15-11-9-13(2)10-12-15)22-16(19)14-7-5-4-6-8-14/h4-12,18H,3H2,1-2H3/t18-/m1/s1
InChIKey IQRODUZCEYPKJF-GOSISDBHSA-N
Mol Weight 330.4 g/mol
Molecular Formula C18H18O4S
Exact Mass 330.09258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HiKc7yI2ycQ
Name (R*)-Ethyl benzoyloxy-[( 4-methylphenyl)sulfanyl]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C18H18O4S
InChI InChI=1S/C18H18O4S/c1-3-21-17(20)18(23-15-11-9-13(2)10-12-15)22-16(19)14-7-5-4-6-8-14/h4-12,18H,3H2,1-2H3/t18-/m1/s1
InChIKey IQRODUZCEYPKJF-GOSISDBHSA-N
Molecular Weight 330.398 g/mol
SMILES [C@@](OC(=O)c1ccccc1)(C(=O)OCC)(Sc1ccc(cc1)C)[H]
SPLASH splash10-0a4i-0904000000-917e9fde129a64f5359f
Source of Spectrum QC-8-309-5d
Wiley ID 869619