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Dimethyl 4,4'-(thiobis(methylene))dibenzoate
SpectraBase Compound ID CmbdtVJ5i2u
InChI InChI=1S/C18H18O4S/c1-21-17(19)15-7-3-13(4-8-15)11-23-12-14-5-9-16(10-6-14)18(20)22-2/h3-10H,11-12H2,1-2H3
InChIKey SLWBSPRPGKACEC-UHFFFAOYSA-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 AdEgauO1YFE
Name 4,4'-(thiobis(methylene))dibenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.092580230 u
Formula C18H18O4S
InChI InChI=1S/C18H18O4S/c1-21-17(19)15-7-3-13(4-8-15)11-23-12-14-5-9-16(10-6-14)18(20)22-2/h3-10H,11-12H2,1-2H3
InChIKey SLWBSPRPGKACEC-UHFFFAOYSA-N
Instrument Name JEOL AccuTOF GCx
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/ejoc.202201383
Molecular Weight 330.398 g/mol
Quality 170
SMILES C(C1=CC=C(C=C1)CSCC1=CC=C(C(=O)OC)C=C1)(OC)=O
SPLASH splash10-0002-1903000000-fbb51ece6049099d18b0
Source of Spectrum K1-26-SM17-2e (DOI: 10.1002/ejoc.202201383)
Thin-Layer Chromatography 0.35 (SiO2, PE/EE, 2:1)
Wiley ID 1910521